2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide

C111H129ClF6N20O6S — CID 160760961

About 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide

2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide (PubChem CID 160760961) has the molecular formula C111H129ClF6N20O6S and a molecular weight of 2020.89 g/mol. Its IUPAC name is 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide.

Molecular Properties

• Compound Name: 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide
• PubChem CID: 160760961
• Molecular Formula: C111H129ClF6N20O6S
• Molecular Weight: 2020.89 g/mol
• Exact Mass: 2018.97
• IUPAC Name: 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide
• SMILES: C=CCN(Cc1nc2cccnc2n1CC(C)C)C(=O)c1ccccc1F.CC(C)CCN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1c(F)cc(F)cc1F.CC(C)CCN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1ccccc1Cl.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(F)c(F)c2)nc2cccnc21.COc1cscc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1CC1CC1
• InChI: InChI=1S/C23H27ClN4O.C23H25F3N4O.C22H26F2N4O.C22H28N4O2S.C21H23FN4O/c1-16(2)11-13-27(23(29)18-6-3-4-7-19(18)24)15-21-26-20-8-5-12-25-22(20)28(21)14-17-9-10-17;1-14(2)7-9-29(23(31)21-17(25)10-16(24)11-18(21)26)13-20-28-19-4-3-8-27-22(19)30(20)12-15-5-6-15;1-4-11-28-20(26-19-6-5-10-25-21(19)28)14-27(12-9-15(2)3)22(29)16-7-8-17(23)18(24)13-16;1-15(2)8-10-25(22(27)17-13-29-14-19(17)28-3)12-20-24-18-5-4-9-23-21(18)26(20)11-16-6-7-16;1-4-12-25(21(27)16-8-5-6-9-17(16)22)14-19-24-18-10-7-11-23-20(18)26(19)13-15(2)3/h3-8,12,16-17H,9-11,13-15H2,1-2H3;3-4,8,10-11,14-15H,5-7,9,12-13H2,1-2H3;5-8,10,13,15H,4,9,11-12,14H2,1-3H3;4-5,9,13-16H,6-8,10-12H2,1-3H3;4-11,15H,1,12-14H2,2-3H3
• InChIKey: RYBFZRFBZFNQGA-UHFFFAOYSA-N
• XLogP: 23.59
• TPSA: 264.33 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 40
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2020.89
LogP ≤ 5	23.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide?

The IUPAC name of 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide (CID 160760961) is 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide.

What is the SMILES notation for 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide?

The canonical SMILES for 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide is C=CCN(Cc1nc2cccnc2n1CC(C)C)C(=O)c1ccccc1F.CC(C)CCN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1c(F)cc(F)cc1F.CC(C)CCN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1ccccc1Cl.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(F)c(F)c2)nc2cccnc21.COc1cscc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1CC1CC1.

What is the InChIKey of 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide?

The InChIKey is RYBFZRFBZFNQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27ClN4O.C23H25F3N4O.C22H26F2N4O.C22H28N4O2S.C21H23FN4O/c1-16(2)11-13-27(23(29)18-6-3-4-7-19(18)24)15-21-26-20-8-5-12-25-22(20)28(21)14-17-9-10-17;1-14(2)7-9-29(23(31)21-17(25)10-16(24)11-18(21)26)13-20-28-19-4-3-8-27-22(19)30(20)12-15-5-6-15;1-4-11-28-20(26-19-6-5-10-25-21(19)28)14-27(12-9-15(2)3)22(29)16-7-8-17(23)18(24)13-16;1-15(2)8-10-25(22(27)17-13-29-14-19(17)28-3)12-20-24-18-5-4-9-23-21(18)26(20)11-16-6-7-16;1-4-12-25(21(27)16-8-5-6-9-17(16)22)14-19-24-18-10-7-11-23-20(18)26(19)13-15(2)3/h3-8,12,16-17H,9-11,13-15H2,1-2H3;3-4,8,10-11,14-15H,5-7,9,12-13H2,1-2H3;5-8,10,13,15H,4,9,11-12,14H2,1-3H3;4-5,9,13-16H,6-8,10-12H2,1-3H3;4-11,15H,1,12-14H2,2-3H3.

What are the key properties of 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide?

2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide has a molecular weight of 2020.89 g/mol, XLogP of 23.59, 40 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-methoxy-N-(3-methylbutyl)thiophene-3-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2,4,6-trifluoro-N-(3-methylbutyl)benzamide;3,4-difluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-fluoro-N-[[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-prop-2-enylbenzamide is sourced from PubChem (CID 160760961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).