N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide

C130H134N26O12S5 — CID 158140149

IUPACN-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide
SMILESCC[C@@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4c(c3)cc(C)n4C(=O)NC3CC3)c2s1.COC[C@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4c(c3)cc(C)n4C(=O)NC3CC3)c2s1.CO[C@@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5c(c4)cc(C)n5C(=O)NC4CC4)c3s2)C1.CO[C@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5c(c4)cc(C)n5C(=O)NC4CC4)c3s2)C1.Cc1cc2cc(Nc3ccnc4cc(-c5nccn5C)sc34)ccc2n1C(=O)NC1CC1
InChIInChI=1S/C27H29N5O3S.C27H29N5O2S.2C26H27N5O3S.C24H22N6OS/c1-16-12-17-13-19(7-8-23(17)32(16)27(34)30-18-5-6-18)29-21-9-10-28-22-14-24(36-25(21)22)26(33)31-11-3-4-20(31)15-35-2;1-3-20-5-4-12-31(20)26(33)24-15-22-25(35-24)21(10-11-28-22)29-19-8-9-23-17(14-19)13-16(2)32(23)27(34)30-18-6-7-18;2*1-15-11-16-12-18(5-6-22(16)31(15)26(33)29-17-3-4-17)28-20-7-9-27-21-13-23(35-24(20)21)25(32)30-10-8-19(14-30)34-2;1-14-11-15-12-17(5-6-20(15)30(14)24(31)28-16-3-4-16)27-18-7-8-25-19-13-21(32-22(18)19)23-26-9-10-29(23)2/h7-10,12-14,18,20H,3-6,11,15H2,1-2H3,(H,28,29)(H,30,34);8-11,13-15,18,20H,3-7,12H2,1-2H3,(H,28,29)(H,30,34);2*5-7,9,11-13,17,19H,3-4,8,10,14H2,1-2H3,(H,27,28)(H,29,33);5-13,16H,3-4H2,1-2H3,(H,25,27)(H,28,31)/t2*20-;2*19-;/m1110./s1
InChIKeyFTVHXOGPTICNLM-XBZDZHJQSA-N
MW2413.01 g/mol
LogP26.50
Rot. Bonds25

About N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide

N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide (PubChem CID 158140149) has the molecular formula C130H134N26O12S5 and a molecular weight of 2413.01 g/mol. Its IUPAC name is N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide
PubChem CID158140149
Molecular FormulaC130H134N26O12S5
Molecular Weight2413.01 g/mol
Exact Mass2410.93
IUPAC NameN-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide
SMILESCC[C@@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4c(c3)cc(C)n4C(=O)NC3CC3)c2s1.COC[C@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4c(c3)cc(C)n4C(=O)NC3CC3)c2s1.CO[C@@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5c(c4)cc(C)n5C(=O)NC4CC4)c3s2)C1.CO[C@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5c(c4)cc(C)n5C(=O)NC4CC4)c3s2)C1.Cc1cc2cc(Nc3ccnc4cc(-c5nccn5C)sc34)ccc2n1C(=O)NC1CC1
InChIInChI=1S/C27H29N5O3S.C27H29N5O2S.2C26H27N5O3S.C24H22N6OS/c1-16-12-17-13-19(7-8-23(17)32(16)27(34)30-18-5-6-18)29-21-9-10-28-22-14-24(36-25(21)22)26(33)31-11-3-4-20(31)15-35-2;1-3-20-5-4-12-31(20)26(33)24-15-22-25(35-24)21(10-11-28-22)29-19-8-9-23-17(14-19)13-16(2)32(23)27(34)30-18-6-7-18;2*1-15-11-16-12-18(5-6-22(16)31(15)26(33)29-17-3-4-17)28-20-7-9-27-21-13-23(35-24(20)21)25(32)30-10-8-19(14-30)34-2;1-14-11-15-12-17(5-6-20(15)30(14)24(31)28-16-3-4-16)27-18-7-8-25-19-13-21(32-22(18)19)23-26-9-10-29(23)2/h7-10,12-14,18,20H,3-6,11,15H2,1-2H3,(H,28,29)(H,30,34);8-11,13-15,18,20H,3-7,12H2,1-2H3,(H,28,29)(H,30,34);2*5-7,9,11-13,17,19H,3-4,8,10,14H2,1-2H3,(H,27,28)(H,29,33);5-13,16H,3-4H2,1-2H3,(H,25,27)(H,28,31)/t2*20-;2*19-;/m1110./s1
InChIKeyFTVHXOGPTICNLM-XBZDZHJQSA-N
XLogP26.50
TPSA421.50 Ų
H-Bond Donors10
H-Bond Acceptors34
Rotatable Bonds25
Heavy Atoms173
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002413.01
LogP ≤ 526.50
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1034

Analyze N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide?
The IUPAC name of N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide (CID 158140149) is N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide?
The canonical SMILES for N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide is CC[C@@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4c(c3)cc(C)n4C(=O)NC3CC3)c2s1.COC[C@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4c(c3)cc(C)n4C(=O)NC3CC3)c2s1.CO[C@@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5c(c4)cc(C)n5C(=O)NC4CC4)c3s2)C1.CO[C@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5c(c4)cc(C)n5C(=O)NC4CC4)c3s2)C1.Cc1cc2cc(Nc3ccnc4cc(-c5nccn5C)sc34)ccc2n1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide?
The InChIKey is FTVHXOGPTICNLM-XBZDZHJQSA-N. The full InChI is InChI=1S/C27H29N5O3S.C27H29N5O2S.2C26H27N5O3S.C24H22N6OS/c1-16-12-17-13-19(7-8-23(17)32(16)27(34)30-18-5-6-18)29-21-9-10-28-22-14-24(36-25(21)22)26(33)31-11-3-4-20(31)15-35-2;1-3-20-5-4-12-31(20)26(33)24-15-22-25(35-24)21(10-11-28-22)29-19-8-9-23-17(14-19)13-16(2)32(23)27(34)30-18-6-7-18;2*1-15-11-16-12-18(5-6-22(16)31(15)26(33)29-17-3-4-17)28-20-7-9-27-21-13-23(35-24(20)21)25(32)30-10-8-19(14-30)34-2;1-14-11-15-12-17(5-6-20(15)30(14)24(31)28-16-3-4-16)27-18-7-8-25-19-13-21(32-22(18)19)23-26-9-10-29(23)2/h7-10,12-14,18,20H,3-6,11,15H2,1-2H3,(H,28,29)(H,30,34);8-11,13-15,18,20H,3-7,12H2,1-2H3,(H,28,29)(H,30,34);2*5-7,9,11-13,17,19H,3-4,8,10,14H2,1-2H3,(H,27,28)(H,29,33);5-13,16H,3-4H2,1-2H3,(H,25,27)(H,28,31)/t2*20-;2*19-;/m1110./s1.
What are the key properties of N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide?
N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide has a molecular weight of 2413.01 g/mol, XLogP of 26.50, 25 rotatable bonds, 10 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(2R)-2-(methoxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-5-[[2-[(3S)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]amino]-2-methylindole-1-carboxamide;N-cyclopropyl-2-methyl-5-[[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]amino]indole-1-carboxamide is sourced from PubChem (CID 158140149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).