N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide

C168H188FN21O22 — CID 158260688

IUPACN-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide
SMILESCC(C)N1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cccnc4F)cc3)ccc1O2.CC(C)N1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cnn(C)c4)cn3)ccc1O2.CCCCONC(=O)c1ccc(-c2ccc3c(c2)C(=O)CC2(CCN(C(C)C)CC2)O3)cc1.CCCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cncc(C)c4)cc3)ccc1O2.CCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cc(C)no4)cn3)ccc1O2.Cc1cc(CNC(=O)c2ccc(-c3ccc4c(c3)C(=O)CC3(CCN(CC5(C)COC5)CC3)O4)nc2)on1
InChIInChI=1S/C30H33N3O3.C29H30FN3O3.C29H32N4O5.C27H31N5O3.C27H34N2O4.C26H28N4O4/c1-3-12-33-13-10-30(11-14-33)17-27(34)26-16-25(8-9-28(26)36-30)23-4-6-24(7-5-23)29(35)32-20-22-15-21(2)18-31-19-22;1-19(2)33-14-11-29(12-15-33)17-25(34)24-16-22(9-10-26(24)36-29)20-5-7-21(8-6-20)28(35)32-18-23-4-3-13-31-27(23)30;1-19-11-22(38-32-19)15-31-27(35)21-3-5-24(30-14-21)20-4-6-26-23(12-20)25(34)13-29(37-26)7-9-33(10-8-29)16-28(2)17-36-18-28;1-18(2)32-10-8-27(9-11-32)13-24(33)22-12-20(5-7-25(22)35-27)23-6-4-21(16-28-23)26(34)29-14-19-15-30-31(3)17-19;1-4-5-16-32-28-26(31)21-8-6-20(7-9-21)22-10-11-25-23(17-22)24(30)18-27(33-25)12-14-29(15-13-27)19(2)3;1-3-30-10-8-26(9-11-30)14-23(31)21-13-18(5-7-24(21)33-26)22-6-4-19(15-27-22)25(32)28-16-20-12-17(2)29-34-20/h4-9,15-16,18-19H,3,10-14,17,20H2,1-2H3,(H,32,35);3-10,13,16,19H,11-12,14-15,17-18H2,1-2H3,(H,32,35);3-6,11-12,14H,7-10,13,15-18H2,1-2H3,(H,31,35);4-7,12,15-18H,8-11,13-14H2,1-3H3,(H,29,34);6-11,17,19H,4-5,12-16,18H2,1-3H3,(H,28,31);4-7,12-13,15H,3,8-11,14,16H2,1-2H3,(H,28,32)
InChIKeyGHVKPZNJUMYWJN-UHFFFAOYSA-N
MW2872.47 g/mol
LogP26.47
Rot. Bonds34

About N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide

N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide (PubChem CID 158260688) has the molecular formula C168H188FN21O22 and a molecular weight of 2872.47 g/mol. Its IUPAC name is N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide.

Molecular Properties

Compound NameN-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide
PubChem CID158260688
Molecular FormulaC168H188FN21O22
Molecular Weight2872.47 g/mol
Exact Mass2870.42
IUPAC NameN-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide
SMILESCC(C)N1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cccnc4F)cc3)ccc1O2.CC(C)N1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cnn(C)c4)cn3)ccc1O2.CCCCONC(=O)c1ccc(-c2ccc3c(c2)C(=O)CC2(CCN(C(C)C)CC2)O3)cc1.CCCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cncc(C)c4)cc3)ccc1O2.CCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cc(C)no4)cn3)ccc1O2.Cc1cc(CNC(=O)c2ccc(-c3ccc4c(c3)C(=O)CC3(CCN(CC5(C)COC5)CC3)O4)nc2)on1
InChIInChI=1S/C30H33N3O3.C29H30FN3O3.C29H32N4O5.C27H31N5O3.C27H34N2O4.C26H28N4O4/c1-3-12-33-13-10-30(11-14-33)17-27(34)26-16-25(8-9-28(26)36-30)23-4-6-24(7-5-23)29(35)32-20-22-15-21(2)18-31-19-22;1-19(2)33-14-11-29(12-15-33)17-25(34)24-16-22(9-10-26(24)36-29)20-5-7-21(8-6-20)28(35)32-18-23-4-3-13-31-27(23)30;1-19-11-22(38-32-19)15-31-27(35)21-3-5-24(30-14-21)20-4-6-26-23(12-20)25(34)13-29(37-26)7-9-33(10-8-29)16-28(2)17-36-18-28;1-18(2)32-10-8-27(9-11-32)13-24(33)22-12-20(5-7-25(22)35-27)23-6-4-21(16-28-23)26(34)29-14-19-15-30-31(3)17-19;1-4-5-16-32-28-26(31)21-8-6-20(7-9-21)22-10-11-25-23(17-22)24(30)18-27(33-25)12-14-29(15-13-27)19(2)3;1-3-30-10-8-26(9-11-30)14-23(31)21-13-18(5-7-24(21)33-26)22-6-4-19(15-27-22)25(32)28-16-20-12-17(2)29-34-20/h4-9,15-16,18-19H,3,10-14,17,20H2,1-2H3,(H,32,35);3-10,13,16,19H,11-12,14-15,17-18H2,1-2H3,(H,32,35);3-6,11-12,14H,7-10,13,15-18H2,1-2H3,(H,31,35);4-7,12,15-18H,8-11,13-14H2,1-3H3,(H,29,34);6-11,17,19H,4-5,12-16,18H2,1-3H3,(H,28,31);4-7,12-13,15H,3,8-11,14,16H2,1-2H3,(H,28,32)
InChIKeyGHVKPZNJUMYWJN-UHFFFAOYSA-N
XLogP26.47
TPSA504.63 Ų
H-Bond Donors6
H-Bond Acceptors37
Rotatable Bonds34
Heavy Atoms212
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002872.47
LogP ≤ 526.47
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide with MolForge

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Related Compounds

(2S)-2-cycloheptyl-5,5-difluoro-5-(6-methoxy-3-pyridinyl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxopentanamide;(2S)-2-cycloheptyl-4-(2-ethylpyrazol-3-yl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxobutanamide;N-[(1S)-1-cycloheptyl-3-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-2-oxopropyl]-2-propan-2-ylpyrazole-3-carboxamide;(2S)-2-cyclohexyl-4-(3-ethyl-1,2-oxazol-4-yl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxobutanamide
CID 159752161
CID 161097175
CID 161097175
4-Tert-butyl-3,5-dimethyl-1,2-oxazole;1-[2-(4-tert-butylphenoxy)ethyl]piperidine;(4-tert-butylphenyl)-(4,4-difluoropiperidin-1-yl)methanone;(4-tert-butylphenyl)-(4-hydroxy-4-methylpiperidin-1-yl)methanone;4-[(4-tert-butylphenyl)methyl]morpholine;4-(4-tert-butylphenyl)morpholine;(4-tert-butylphenyl)-morpholin-4-ylmethanone;1-(4-tert-butylphenyl)piperazine;4-tert-butyl-1-propylpyrazole;1-(3,3-difluoroazetidin-1-yl)-2,2-dimethylpropan-1-one;1-(3,3-difluoropyrrolidin-1-yl)-2,2-dimethylpropan-1-one;ethane
CID 161330666
(2S)-2-cycloheptyl-5,5-difluoro-5-(6-methoxy-3-pyridinyl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxopentanamide;(2S)-2-cycloheptyl-4-(2-ethylpyrazol-3-yl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxobutanamide;N-[(1S)-1-cycloheptyl-3-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-2-oxopropyl]-2-propan-2-ylpyrazole-3-carboxamide;(2S)-2-cyclohexyl-5,5-difluoro-5-(6-methoxy-3-pyridinyl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxopentanamide;(2S)-2-cyclohexyl-4-(3-ethyl-1,2-oxazol-4-yl)-N-[4-[(2S,3R)-4-(4-methylpiperazin-1-yl)-4-oxo-3-(propanoylamino)butan-2-yl]phenyl]-4-oxobutanamide
CID 167668387
(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2S)-1-(3,4-dihydro-2H-chromen-6-ylmethylamino)-1-oxo-4-phenylbutan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2S)-1-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methylamino]-1-oxo-4-phenylbutan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2S)-1-[[3-(2-methylpyrazol-3-yl)phenyl]methylamino]-1-oxo-4-phenylbutan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2S)-1-[[4-(oxan-4-yloxy)phenyl]methylamino]-1-oxo-4-phenylbutan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2S)-1-oxo-4-phenyl-1-[[4-[(E)-2-phenylethenyl]phenyl]methylamino]butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2S)-1-oxo-4-phenyl-1-(pyrazolo[1,5-a]pyridin-2-ylmethylamino)butan-2-yl]butanediamide
CID 160203817
6-[1'-(3-methoxypropyl)spiro[chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(1'-propylspiro[chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;6-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 160615757
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-1,3-benzoxazine-2,4'-piperidine]-6-yl)benzamide;6-[1'-(3-methoxypropyl)-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-1,3-benzoxazine-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-1,3-benzoxazine-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;4-(3-methyl-4-oxo-1'-propan-2-ylspiro[1,3-benzoxazine-2,4'-piperidine]-6-yl)-N-[(6-methyl-3-pyridinyl)methyl]benzamide
CID 161272540
1-(2-carboxyethyl)-4-methyl-5-[6-[3-methyl-2-[[2-(oxan-4-yl)-3,4-dihydro-1H-isoquinolin-6-yl]methoxy]phenyl]-2-pyridinyl]pyrazole-3-carboxylic acid;1-ethyl-4,5-dimethylpyrazole-3-carboxylic acid;4-methyl-5-[6-[3-methyl-2-[[2-(oxan-4-yl)-3,4-dihydro-1H-isoquinolin-6-yl]methoxy]phenyl]-2-pyridinyl]-1,2-oxazole-3-carboxylic acid;6-[(2-methyl-6-pyridin-2-ylphenoxy)methyl]-2-(oxan-4-yl)-3,4-dihydro-1H-isoquinoline
CID 161340045

Frequently Asked Questions

What is the IUPAC name of N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide?
The IUPAC name of N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide (CID 158260688) is N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide.
What is the SMILES notation for N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide?
The canonical SMILES for N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide is CC(C)N1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cccnc4F)cc3)ccc1O2.CC(C)N1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cnn(C)c4)cn3)ccc1O2.CCCCONC(=O)c1ccc(-c2ccc3c(c2)C(=O)CC2(CCN(C(C)C)CC2)O3)cc1.CCCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cncc(C)c4)cc3)ccc1O2.CCN1CCC2(CC1)CC(=O)c1cc(-c3ccc(C(=O)NCc4cc(C)no4)cn3)ccc1O2.Cc1cc(CNC(=O)c2ccc(-c3ccc4c(c3)C(=O)CC3(CCN(CC5(C)COC5)CC3)O4)nc2)on1.
What is the InChIKey of N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide?
The InChIKey is GHVKPZNJUMYWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H33N3O3.C29H30FN3O3.C29H32N4O5.C27H31N5O3.C27H34N2O4.C26H28N4O4/c1-3-12-33-13-10-30(11-14-33)17-27(34)26-16-25(8-9-28(26)36-30)23-4-6-24(7-5-23)29(35)32-20-22-15-21(2)18-31-19-22;1-19(2)33-14-11-29(12-15-33)17-25(34)24-16-22(9-10-26(24)36-29)20-5-7-21(8-6-20)28(35)32-18-23-4-3-13-31-27(23)30;1-19-11-22(38-32-19)15-31-27(35)21-3-5-24(30-14-21)20-4-6-26-23(12-20)25(34)13-29(37-26)7-9-33(10-8-29)16-28(2)17-36-18-28;1-18(2)32-10-8-27(9-11-32)13-24(33)22-12-20(5-7-25(22)35-27)23-6-4-21(16-28-23)26(34)29-14-19-15-30-31(3)17-19;1-4-5-16-32-28-26(31)21-8-6-20(7-9-21)22-10-11-25-23(17-22)24(30)18-27(33-25)12-14-29(15-13-27)19(2)3;1-3-30-10-8-26(9-11-30)14-23(31)21-13-18(5-7-24(21)33-26)22-6-4-19(15-27-22)25(32)28-16-20-12-17(2)29-34-20/h4-9,15-16,18-19H,3,10-14,17,20H2,1-2H3,(H,32,35);3-10,13,16,19H,11-12,14-15,17-18H2,1-2H3,(H,32,35);3-6,11-12,14H,7-10,13,15-18H2,1-2H3,(H,31,35);4-7,12,15-18H,8-11,13-14H2,1-3H3,(H,29,34);6-11,17,19H,4-5,12-16,18H2,1-3H3,(H,28,31);4-7,12-13,15H,3,8-11,14,16H2,1-2H3,(H,28,32).
What are the key properties of N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide?
N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide has a molecular weight of 2872.47 g/mol, XLogP of 26.47, 34 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for N-butoxy-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;6-(1'-ethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide;N-[(2-fluoro-3-pyridinyl)methyl]-4-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide;N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-[1'-[(3-methyloxetan-3-yl)methyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]pyridine-3-carboxamide;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-oxo-1'-propan-2-ylspiro[3H-chromene-2,4'-piperidine]-6-yl)pyridine-3-carboxamide;N-[(5-methyl-3-pyridinyl)methyl]-4-(4-oxo-1'-propylspiro[3H-chromene-2,4'-piperidine]-6-yl)benzamide is sourced from PubChem (CID 158260688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).