N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide

C88H96Cl5N13O9 — CID 162153861

IUPACN-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide
SMILESCC(=O)N1CCC(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1.CC(C)C(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCOCC1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(OCCN(C)C)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ncco1
InChIInChI=1S/C21H24ClN3O2.C19H19ClN2O.C18H22ClN3O2.C16H19ClN2O2.C14H12ClN3O2/c1-14(15-4-7-18(8-5-15)27-11-10-25(2)3)23-21(26)20-13-16-12-17(22)6-9-19(16)24-20;1-12(2)18(13-6-4-3-5-7-13)22-19(23)17-11-14-10-15(20)8-9-16(14)21-17;1-11(13-5-7-22(8-6-13)12(2)23)20-18(24)17-10-14-9-15(19)3-4-16(14)21-17;1-10(11-4-6-21-7-5-11)18-16(20)15-9-12-8-13(17)2-3-14(12)19-15;1-8(14-16-4-5-20-14)17-13(19)12-7-9-6-10(15)2-3-11(9)18-12/h4-9,12-14,24H,10-11H2,1-3H3,(H,23,26);3-12,18,21H,1-2H3,(H,22,23);3-4,9-11,13,21H,5-8H2,1-2H3,(H,20,24);2-3,8-11,19H,4-7H2,1H3,(H,18,20);2-8,18H,1H3,(H,17,19)
InChIKeyZLOHPYMSOHUKAM-UHFFFAOYSA-N
MW1657.08 g/mol
LogP19.07
Rot. Bonds20

About N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide

N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide (PubChem CID 162153861) has the molecular formula C88H96Cl5N13O9 and a molecular weight of 1657.08 g/mol. Its IUPAC name is N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide
PubChem CID162153861
Molecular FormulaC88H96Cl5N13O9
Molecular Weight1657.08 g/mol
Exact Mass1653.59
IUPAC NameN-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide
SMILESCC(=O)N1CCC(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1.CC(C)C(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCOCC1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(OCCN(C)C)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ncco1
InChIInChI=1S/C21H24ClN3O2.C19H19ClN2O.C18H22ClN3O2.C16H19ClN2O2.C14H12ClN3O2/c1-14(15-4-7-18(8-5-15)27-11-10-25(2)3)23-21(26)20-13-16-12-17(22)6-9-19(16)24-20;1-12(2)18(13-6-4-3-5-7-13)22-19(23)17-11-14-10-15(20)8-9-16(14)21-17;1-11(13-5-7-22(8-6-13)12(2)23)20-18(24)17-10-14-9-15(19)3-4-16(14)21-17;1-10(11-4-6-21-7-5-11)18-16(20)15-9-12-8-13(17)2-3-14(12)19-15;1-8(14-16-4-5-20-14)17-13(19)12-7-9-6-10(15)2-3-11(9)18-12/h4-9,12-14,24H,10-11H2,1-3H3,(H,23,26);3-12,18,21H,1-2H3,(H,22,23);3-4,9-11,13,21H,5-8H2,1-2H3,(H,20,24);2-3,8-11,19H,4-7H2,1H3,(H,18,20);2-8,18H,1H3,(H,17,19)
InChIKeyZLOHPYMSOHUKAM-UHFFFAOYSA-N
XLogP19.07
TPSA292.49 Ų
H-Bond Donors10
H-Bond Acceptors11
Rotatable Bonds20
Heavy Atoms115
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001657.08
LogP ≤ 519.07
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1011

Analyze N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide with MolForge

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Related Compounds

4-[3-chloro-5-[2-fluoro-5-[4-(4-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-5-yl]phenyl]phenyl]-5-[3-chloro-5-[3-[2-[3-(1H-indol-3-yl)propyl]-5-(3-methoxyphenyl)-1,3-oxazol-4-yl]-5-methoxyphenyl]phenyl]-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole
CID 126495200
5-chloro-N-[1-(1,3-oxazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-ethoxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-ethoxy-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-ethoxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
CID 157609776
5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(2-methoxyethoxy)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropyl)-1H-indole-2-carboxamide;(3S)-1-(6-methoxy-1H-indol-2-yl)-3-phenylbutan-1-one;5-N-methyl-2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 161369133
5-chloro-N-[1-(1,3-oxazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-ethoxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-ethoxy-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
CID 161498215
(2S)-1-[2-(5-methoxy-1H-indol-3-yl)acetyl]-N-[4-[2-[4-[[(2S)-1-[2-(5-methoxy-1H-indol-3-yl)acetyl]pyrrolidine-2-carbonyl]amino]phenyl]-1,3-oxazol-5-yl]phenyl]pyrrolidine-2-carboxamide
CID 71232115
1-[2-(5-methoxy-1H-indol-3-yl)acetyl]-N-[4-[2-[4-[[1-[2-(5-methoxy-1H-indol-3-yl)acetyl]pyrrolidine-2-carbonyl]amino]phenyl]-1,3-oxazol-5-yl]phenyl]pyrrolidine-2-carboxamide
CID 78042906
(4-Methylphenyl) 1-[4-[3-butan-2-yloxy-4-(pyridine-2-carbonylamino)butoxy]phenyl]-6-chloro-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
CID 91245733
(2S)-N-[2-(5-methoxy-1H-indol-3-yl)acetyl]-N-[4-[2-[4-[[2-(5-methoxy-1H-indol-3-yl)acetyl]-[(2S)-pyrrolidine-2-carbonyl]amino]phenyl]-1,3-oxazol-5-yl]phenyl]pyrrolidine-2-carboxamide
CID 124029473
(4-methylphenyl) (1S)-6-chloro-1-[4-[3-iodooxy-4-(pyridine-2-carbonylamino)butoxy]phenyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
CID 144099904
5-chloro-N-[(4-fluorophenyl)methyl]-1H-indole-2-carboxamide;N-[(3-chlorophenyl)methyl]-1H-indole-2-carboxamide;5-fluoro-N-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(4-fluorophenyl)methyl]-5-methyl-1H-indole-2-carboxamide;5-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide
CID 157079970
[6-Chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-(4-phenylphenyl)methanone;ethyl 6-chloro-1-[4-[3-(dimethylamino)propoxy]phenyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate;ethyl 6-chloro-1-[4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylcarbamoyl]phenyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate;propan-2-yl 6-chloro-1-[4-[3-(dimethylamino)propoxy]phenyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
CID 157221464
5-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-cyclohexylethyl)-1H-indole-2-carboxamide;5-chloro-N-(3-methylbutan-2-yl)-1H-indole-2-carboxamide;5-chloro-N-(2-phenylpropan-2-yl)-1H-indole-2-carboxamide;6-fluoro-N-naphthalen-1-yl-1H-indole-2-carboxamide;6-fluoro-N-quinolin-5-yl-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-1,3-benzoxazole-2-carboxamide
CID 157234091

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide (CID 162153861) is N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide is CC(=O)N1CCC(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1.CC(C)C(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCOCC1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(OCCN(C)C)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ncco1.
What is the InChIKey of N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide?
The InChIKey is ZLOHPYMSOHUKAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O2.C19H19ClN2O.C18H22ClN3O2.C16H19ClN2O2.C14H12ClN3O2/c1-14(15-4-7-18(8-5-15)27-11-10-25(2)3)23-21(26)20-13-16-12-17(22)6-9-19(16)24-20;1-12(2)18(13-6-4-3-5-7-13)22-19(23)17-11-14-10-15(20)8-9-16(14)21-17;1-11(13-5-7-22(8-6-13)12(2)23)20-18(24)17-10-14-9-15(19)3-4-16(14)21-17;1-10(11-4-6-21-7-5-11)18-16(20)15-9-12-8-13(17)2-3-14(12)19-15;1-8(14-16-4-5-20-14)17-13(19)12-7-9-6-10(15)2-3-11(9)18-12/h4-9,12-14,24H,10-11H2,1-3H3,(H,23,26);3-12,18,21H,1-2H3,(H,22,23);3-4,9-11,13,21H,5-8H2,1-2H3,(H,20,24);2-3,8-11,19H,4-7H2,1H3,(H,18,20);2-8,18H,1H3,(H,17,19).
What are the key properties of N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide?
N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide has a molecular weight of 1657.08 g/mol, XLogP of 19.07, 20 rotatable bonds, 10 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-acetylpiperidin-4-yl)ethyl]-5-chloro-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-[1-(oxan-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1,3-oxazol-2-yl)ethyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 162153861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).