amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine

C119H141N29O8 — CID 163571340

IUPACamino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
SMILESCOCCNc1nc(N2CCCC2)nc2cc(C#CCN3CCCC3)c(OC)cc12.COc1cc2c(NC(=O)ON)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3ccccn3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3cccnc3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3ccncc3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1
InChIInChI=1S/3C25H28N6O.C23H31N5O2.C21H26N6O3/c1-32-23-17-21-22(16-19(23)8-7-13-30-11-2-3-12-30)28-25(31-14-4-5-15-31)29-24(21)27-20-9-6-10-26-18-20;1-32-23-18-21-22(17-19(23)7-6-14-30-12-2-3-13-30)28-25(31-15-4-5-16-31)29-24(21)27-20-8-10-26-11-9-20;1-32-22-18-20-21(17-19(22)9-8-14-30-12-4-5-13-30)27-25(31-15-6-7-16-31)29-24(20)28-23-10-2-3-11-26-23;1-29-15-9-24-22-19-17-21(30-2)18(8-7-12-27-10-3-4-11-27)16-20(19)25-23(26-22)28-13-5-6-14-28;1-29-18-14-16-17(13-15(18)7-6-10-26-8-2-3-9-26)23-20(27-11-4-5-12-27)24-19(16)25-21(28)30-22/h6,9-10,16-18H,2-5,11-15H2,1H3,(H,27,28,29);8-11,17-18H,2-5,12-16H2,1H3,(H,26,27,28,29);2-3,10-11,17-18H,4-7,12-16H2,1H3,(H,26,27,28,29);16-17H,3-6,9-15H2,1-2H3,(H,24,25,26);13-14H,2-5,8-12,22H2,1H3,(H,23,24,25,28)
InChIKeyFZPDXNIDPIHSMP-UHFFFAOYSA-N
MW2105.63 g/mol
LogP16.33
Rot. Bonds26

About amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine

amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine (PubChem CID 163571340) has the molecular formula C119H141N29O8 and a molecular weight of 2105.63 g/mol. Its IUPAC name is amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine.

Molecular Properties

Compound Nameamino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
PubChem CID163571340
Molecular FormulaC119H141N29O8
Molecular Weight2105.63 g/mol
Exact Mass2104.15
IUPAC Nameamino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
SMILESCOCCNc1nc(N2CCCC2)nc2cc(C#CCN3CCCC3)c(OC)cc12.COc1cc2c(NC(=O)ON)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3ccccn3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3cccnc3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3ccncc3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1
InChIInChI=1S/3C25H28N6O.C23H31N5O2.C21H26N6O3/c1-32-23-17-21-22(16-19(23)8-7-13-30-11-2-3-12-30)28-25(31-14-4-5-15-31)29-24(21)27-20-9-6-10-26-18-20;1-32-23-18-21-22(17-19(23)7-6-14-30-12-2-3-13-30)28-25(31-15-4-5-16-31)29-24(21)27-20-8-10-26-11-9-20;1-32-22-18-20-21(17-19(22)9-8-14-30-12-4-5-13-30)27-25(31-15-6-7-16-31)29-24(20)28-23-10-2-3-11-26-23;1-29-15-9-24-22-19-17-21(30-2)18(8-7-12-27-10-3-4-11-27)16-20(19)25-23(26-22)28-13-5-6-14-28;1-29-18-14-16-17(13-15(18)7-6-10-26-8-2-3-9-26)23-20(27-11-4-5-12-27)24-19(16)25-21(28)30-22/h6,9-10,16-18H,2-5,11-15H2,1H3,(H,27,28,29);8-11,17-18H,2-5,12-16H2,1H3,(H,26,27,28,29);2-3,10-11,17-18H,4-7,12-16H2,1H3,(H,26,27,28,29);16-17H,3-6,9-15H2,1-2H3,(H,24,25,26);13-14H,2-5,8-12,22H2,1H3,(H,23,24,25,28)
InChIKeyFZPDXNIDPIHSMP-UHFFFAOYSA-N
XLogP16.33
TPSA367.82 Ų
H-Bond Donors6
H-Bond Acceptors36
Rotatable Bonds26
Heavy Atoms156
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002105.63
LogP ≤ 516.33
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

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

Analyze amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

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Related Compounds

N-cyclobutyl-2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;N-cyclopropyl-2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(oxetan-3-yl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;N-[2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]cyclopropanecarboxamide;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)-N-(trifluoromethyl)quinazolin-4-amine
CID 163489404
2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-[(1-methylpiperidin-4-yl)methyl]-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(morpholin-4-ylmethyl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(oxetan-3-yl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(piperazin-1-ylmethyl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(piperidin-4-ylmethyl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
CID 163663534
N-cyclopentyl-2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(5-methylfuran-2-yl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyridin-2-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyridin-3-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyridin-4-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
CID 163840785
N-(3,5-difluorophenyl)-2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-piperidin-2-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-piperidin-3-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-piperidin-4-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyrrolidin-3-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
CID 163856429
2-(1,4-diazepan-1-yl)-6-methoxy-N-(oxan-4-yl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(methoxymethyl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-piperidin-4-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-2-N,2-N-dimethyl-4-N-(oxan-4-yl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazoline-2,4-diamine;6-methoxy-2-(4-methylpiperazin-1-yl)-N-(oxan-4-yl)-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine
CID 164038187
N-(3,5-difluorophenyl)-6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;(1S,2S)-1-(dimethylamino)-2-[[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]amino]propan-1-ol;6-methoxy-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;2-[[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]amino]acetonitrile;2,2,2-trifluoro-1-[[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]amino]ethanol
CID 164101832
1-[2-(4,4-Difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]-3-methylurea;1-[2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]piperidin-2-amine;1-[2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]piperidin-3-amine;1-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]piperidin-2-amine;1-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]piperidin-2-ol
CID 164134518
6-cyclohexyloxy-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;6-(2-imidazol-1-ylethoxy)-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;6-methoxy-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]-6-(oxan-2-ylmethoxy)quinazolin-4-amine;N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]-6-(oxan-4-yloxy)quinazolin-4-amine;N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]-6-(oxolan-2-ylmethoxy)quinazolin-4-amine
CID 157644983
1-[8-fluoro-4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-dimethylurea;4-[2-(1H-imidazol-5-yl)ethyl]-6-nitro-2,3-dihydro-1,4-benzoxazine;4-(1H-imidazol-5-ylmethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine;4-(1H-imidazol-5-ylmethyl)-8-methyl-6-nitro-2,3-dihydro-1,4-benzoxazine;methyl N-[8-fluoro-4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methylcarbamate;methyl N-[4-(1H-imidazol-5-ylmethyl)-8-methyl-2,3-dihydro-1,4-benzoxazin-6-yl]carbamate
CID 158365806
2-(2-fluorophenyl)-N-(2-methoxyethyl)-4-pyrrolo[3,2-c]pyridin-1-ylquinazolin-7-amine;2-(3-fluorophenyl)-N-(2-methoxyethyl)-4-pyrrolo[3,2-c]pyridin-1-ylquinazolin-6-amine;2-(2-fluorophenyl)-6-methoxy-4-pyrrolo[3,2-c]pyridin-1-ylquinazoline;2-(2-fluorophenyl)-N-(2-methylbutyl)-4-pyrrolo[3,2-c]pyridin-1-ylquinazolin-6-amine;2-(2-fluorophenyl)-N-methyl-4-pyrrolo[3,2-c]pyridin-1-ylquinazolin-7-amine
CID 158793916
1'-(6-methoxyquinazolin-4-yl)spiro[1H-2-benzofuran-3,4'-piperidine];N-(3-methylphenyl)spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carboxamide;1'-(2-methylquinazolin-4-yl)spiro[1H-2-benzofuran-3,4'-piperidine];1'-quinazolin-4-ylspiro[1H-2-benzofuran-3,4'-piperidine];1'-quinoxalin-2-ylspiro[1H-2-benzofuran-3,4'-piperidine]
CID 158832143
1-[(3S)-3-[4-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylanilino)quinazolin-6-yl]oxypyrrolidin-1-yl]ethanone;N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-6-(2-imidazol-1-ylethoxy)quinazolin-4-amine;N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-6-[(3S)-1-methylpyrrolidin-3-yl]oxyquinazolin-4-amine;N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-6-[(3S)-1-methylsulfonylpyrrolidin-3-yl]oxyquinazolin-4-amine;N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-6-[(3R)-oxolan-3-yl]oxyquinazolin-4-amine;N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-6-[(3S)-oxolan-3-yl]oxyquinazolin-4-amine
CID 158904597

Frequently Asked Questions

What is the IUPAC name of amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine?
The IUPAC name of amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine (CID 163571340) is amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine.
What is the SMILES notation for amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine?
The canonical SMILES for amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine is COCCNc1nc(N2CCCC2)nc2cc(C#CCN3CCCC3)c(OC)cc12.COc1cc2c(NC(=O)ON)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3ccccn3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3cccnc3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.COc1cc2c(Nc3ccncc3)nc(N3CCCC3)nc2cc1C#CCN1CCCC1.
What is the InChIKey of amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine?
The InChIKey is FZPDXNIDPIHSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/3C25H28N6O.C23H31N5O2.C21H26N6O3/c1-32-23-17-21-22(16-19(23)8-7-13-30-11-2-3-12-30)28-25(31-14-4-5-15-31)29-24(21)27-20-9-6-10-26-18-20;1-32-23-18-21-22(17-19(23)7-6-14-30-12-2-3-13-30)28-25(31-15-4-5-16-31)29-24(21)27-20-8-10-26-11-9-20;1-32-22-18-20-21(17-19(22)9-8-14-30-12-4-5-13-30)27-25(31-15-6-7-16-31)29-24(20)28-23-10-2-3-11-26-23;1-29-15-9-24-22-19-17-21(30-2)18(8-7-12-27-10-3-4-11-27)16-20(19)25-23(26-22)28-13-5-6-14-28;1-29-18-14-16-17(13-15(18)7-6-10-26-8-2-3-9-26)23-20(27-11-4-5-12-27)24-19(16)25-21(28)30-22/h6,9-10,16-18H,2-5,11-15H2,1H3,(H,27,28,29);8-11,17-18H,2-5,12-16H2,1H3,(H,26,27,28,29);2-3,10-11,17-18H,4-7,12-16H2,1H3,(H,26,27,28,29);16-17H,3-6,9-15H2,1-2H3,(H,24,25,26);13-14H,2-5,8-12,22H2,1H3,(H,23,24,25,28).
What are the key properties of amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine?
amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine has a molecular weight of 2105.63 g/mol, XLogP of 16.33, 26 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for amino N-[6-methoxy-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-yl]carbamate;6-methoxy-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-2-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-3-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine;6-methoxy-N-pyridin-4-yl-2-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylprop-1-ynyl)quinazolin-4-amine is sourced from PubChem (CID 163571340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).