N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

C113H134ClF3N20O6 — CID 158488089

IUPACN-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
SMILESCC(C)CN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(Cl)cc1.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(C)c(F)c1.CCCn1c(CN(CC(C)C)C(=O)c2ccc(C)cc2)nc2cccnc21.CN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1cc(F)ccc1F.COc1ccccc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1C1CCCC1
InChIInChI=1S/C25H32N4O2.C24H29FN4O.C23H27ClN4O.C22H28N4O.C19H18F2N4O/c1-18(2)14-16-28(25(30)20-11-6-7-13-22(20)31-3)17-23-27-21-12-8-15-26-24(21)29(23)19-9-4-5-10-19;1-3-4-14-28(24(30)18-12-11-17(2)20(25)15-18)16-22-27-21-10-7-13-26-23(21)29(22)19-8-5-6-9-19;1-16(2)14-27(23(29)17-9-11-18(24)12-10-17)15-21-26-20-8-5-13-25-22(20)28(21)19-6-3-4-7-19;1-5-13-26-20(24-19-7-6-12-23-21(19)26)15-25(14-16(2)3)22(27)18-10-8-17(4)9-11-18;1-24(19(26)14-9-13(20)6-7-15(14)21)11-17-23-16-3-2-8-22-18(16)25(17)10-12-4-5-12/h6-8,11-13,15,18-19H,4-5,9-10,14,16-17H2,1-3H3;7,10-13,15,19H,3-6,8-9,14,16H2,1-2H3;5,8-13,16,19H,3-4,6-7,14-15H2,1-2H3;6-12,16H,5,13-15H2,1-4H3;2-3,6-9,12H,4-5,10-11H2,1H3
InChIKeyHIIUQNTYQUQQRV-UHFFFAOYSA-N
MW1960.90 g/mol
LogP24.02
Rot. Bonds33

About N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (PubChem CID 158488089) has the molecular formula C113H134ClF3N20O6 and a molecular weight of 1960.90 g/mol. Its IUPAC name is N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

Molecular Properties

Compound NameN-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
PubChem CID158488089
Molecular FormulaC113H134ClF3N20O6
Molecular Weight1960.90 g/mol
Exact Mass1959.04
IUPAC NameN-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
SMILESCC(C)CN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(Cl)cc1.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(C)c(F)c1.CCCn1c(CN(CC(C)C)C(=O)c2ccc(C)cc2)nc2cccnc21.CN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1cc(F)ccc1F.COc1ccccc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1C1CCCC1
InChIInChI=1S/C25H32N4O2.C24H29FN4O.C23H27ClN4O.C22H28N4O.C19H18F2N4O/c1-18(2)14-16-28(25(30)20-11-6-7-13-22(20)31-3)17-23-27-21-12-8-15-26-24(21)29(23)19-9-4-5-10-19;1-3-4-14-28(24(30)18-12-11-17(2)20(25)15-18)16-22-27-21-10-7-13-26-23(21)29(22)19-8-5-6-9-19;1-16(2)14-27(23(29)17-9-11-18(24)12-10-17)15-21-26-20-8-5-13-25-22(20)28(21)19-6-3-4-7-19;1-5-13-26-20(24-19-7-6-12-23-21(19)26)15-25(14-16(2)3)22(27)18-10-8-17(4)9-11-18;1-24(19(26)14-9-13(20)6-7-15(14)21)11-17-23-16-3-2-8-22-18(16)25(17)10-12-4-5-12/h6-8,11-13,15,18-19H,4-5,9-10,14,16-17H2,1-3H3;7,10-13,15,19H,3-6,8-9,14,16H2,1-2H3;5,8-13,16,19H,3-4,6-7,14-15H2,1-2H3;6-12,16H,5,13-15H2,1-4H3;2-3,6-9,12H,4-5,10-11H2,1H3
InChIKeyHIIUQNTYQUQQRV-UHFFFAOYSA-N
XLogP24.02
TPSA264.33 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds33
Heavy Atoms143
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001960.90
LogP ≤ 524.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?
The IUPAC name of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (CID 158488089) is N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.
What is the SMILES notation for N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?
The canonical SMILES for N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is CC(C)CN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(Cl)cc1.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(C)c(F)c1.CCCn1c(CN(CC(C)C)C(=O)c2ccc(C)cc2)nc2cccnc21.CN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1cc(F)ccc1F.COc1ccccc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1C1CCCC1.
What is the InChIKey of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?
The InChIKey is HIIUQNTYQUQQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N4O2.C24H29FN4O.C23H27ClN4O.C22H28N4O.C19H18F2N4O/c1-18(2)14-16-28(25(30)20-11-6-7-13-22(20)31-3)17-23-27-21-12-8-15-26-24(21)29(23)19-9-4-5-10-19;1-3-4-14-28(24(30)18-12-11-17(2)20(25)15-18)16-22-27-21-10-7-13-26-23(21)29(22)19-8-5-6-9-19;1-16(2)14-27(23(29)17-9-11-18(24)12-10-17)15-21-26-20-8-5-13-25-22(20)28(21)19-6-3-4-7-19;1-5-13-26-20(24-19-7-6-12-23-21(19)26)15-25(14-16(2)3)22(27)18-10-8-17(4)9-11-18;1-24(19(26)14-9-13(20)6-7-15(14)21)11-17-23-16-3-2-8-22-18(16)25(17)10-12-4-5-12/h6-8,11-13,15,18-19H,4-5,9-10,14,16-17H2,1-3H3;7,10-13,15,19H,3-6,8-9,14,16H2,1-2H3;5,8-13,16,19H,3-4,6-7,14-15H2,1-2H3;6-12,16H,5,13-15H2,1-4H3;2-3,6-9,12H,4-5,10-11H2,1H3.
What are the key properties of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?
N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide has a molecular weight of 1960.90 g/mol, XLogP of 24.02, 33 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-4-methylbenzamide;4-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(2-methylpropyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methoxy-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,5-difluoro-N-methylbenzamide;4-methyl-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 158488089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).