4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide

C109H123Cl6N21O5 — CID 158110049

IUPAC4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide
SMILESCCN1CCC(CCn2cnc3c(Cl)c(C(=O)N(CC)c4ccc(C)cc4)cnc32)CC1.CCN1CCC(CCn2cnc3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)CC1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(ncn3CCC3CCN(C)CC3)c2Cl)cc1.Cc1cn(CC2CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12
InChIInChI=1S/C25H32ClN5O.C23H28ClN5O.C22H26ClN5O.C20H20ClN3O.C19H17Cl2N3O/c1-4-29-13-10-19(11-14-29)12-15-30-17-28-23-22(26)21(16-27-24(23)30)25(32)31(5-2)20-8-6-18(3)7-9-20;1-3-28-11-8-17(9-12-28)10-13-29-15-26-21-20(24)19(14-25-22(21)29)23(30)27-18-6-4-16(2)5-7-18;1-15-3-5-17(6-4-15)26-22(29)18-13-24-21-20(19(18)23)25-14-28(21)12-9-16-7-10-27(2)11-8-16;1-12-3-7-15(8-4-12)23-20(25)16-9-22-19-17(18(16)21)13(2)10-24(19)11-14-5-6-14;1-11-9-24(10-12-2-3-12)18-16(11)17(21)15(8-22-18)19(25)23-14-6-4-13(20)5-7-14/h6-9,16-17,19H,4-5,10-15H2,1-3H3;4-7,14-15,17H,3,8-13H2,1-2H3,(H,27,30);3-6,13-14,16H,7-12H2,1-2H3,(H,26,29);3-4,7-10,14H,5-6,11H2,1-2H3,(H,23,25);4-9,12H,2-3,10H2,1H3,(H,23,25)
InChIKeyFQHVIDKJVFESAP-UHFFFAOYSA-N
MW2020.04 g/mol
LogP24.61
Rot. Bonds26

About 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide

4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 158110049) has the molecular formula C109H123Cl6N21O5 and a molecular weight of 2020.04 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID158110049
Molecular FormulaC109H123Cl6N21O5
Molecular Weight2020.04 g/mol
Exact Mass2015.81
IUPAC Name4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide
SMILESCCN1CCC(CCn2cnc3c(Cl)c(C(=O)N(CC)c4ccc(C)cc4)cnc32)CC1.CCN1CCC(CCn2cnc3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)CC1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(ncn3CCC3CCN(C)CC3)c2Cl)cc1.Cc1cn(CC2CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12
InChIInChI=1S/C25H32ClN5O.C23H28ClN5O.C22H26ClN5O.C20H20ClN3O.C19H17Cl2N3O/c1-4-29-13-10-19(11-14-29)12-15-30-17-28-23-22(26)21(16-27-24(23)30)25(32)31(5-2)20-8-6-18(3)7-9-20;1-3-28-11-8-17(9-12-28)10-13-29-15-26-21-20(24)19(14-25-22(21)29)23(30)27-18-6-4-16(2)5-7-18;1-15-3-5-17(6-4-15)26-22(29)18-13-24-21-20(19(18)23)25-14-28(21)12-9-16-7-10-27(2)11-8-16;1-12-3-7-15(8-4-12)23-20(25)16-9-22-19-17(18(16)21)13(2)10-24(19)11-14-5-6-14;1-11-9-24(10-12-2-3-12)18-16(11)17(21)15(8-22-18)19(25)23-14-6-4-13(20)5-7-14/h6-9,16-17,19H,4-5,10-15H2,1-3H3;4-7,14-15,17H,3,8-13H2,1-2H3,(H,27,30);3-6,13-14,16H,7-12H2,1-2H3,(H,26,29);3-4,7-10,14H,5-6,11H2,1-2H3,(H,23,25);4-9,12H,2-3,10H2,1H3,(H,23,25)
InChIKeyFQHVIDKJVFESAP-UHFFFAOYSA-N
XLogP24.61
TPSA274.20 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds26
Heavy Atoms141
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002020.04
LogP ≤ 524.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Analyze 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide (CID 158110049) is 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide is CCN1CCC(CCn2cnc3c(Cl)c(C(=O)N(CC)c4ccc(C)cc4)cnc32)CC1.CCN1CCC(CCn2cnc3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)CC1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(ncn3CCC3CCN(C)CC3)c2Cl)cc1.Cc1cn(CC2CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.
What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is FQHVIDKJVFESAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32ClN5O.C23H28ClN5O.C22H26ClN5O.C20H20ClN3O.C19H17Cl2N3O/c1-4-29-13-10-19(11-14-29)12-15-30-17-28-23-22(26)21(16-27-24(23)30)25(32)31(5-2)20-8-6-18(3)7-9-20;1-3-28-11-8-17(9-12-28)10-13-29-15-26-21-20(24)19(14-25-22(21)29)23(30)27-18-6-4-16(2)5-7-18;1-15-3-5-17(6-4-15)26-22(29)18-13-24-21-20(19(18)23)25-14-28(21)12-9-16-7-10-27(2)11-8-16;1-12-3-7-15(8-4-12)23-20(25)16-9-22-19-17(18(16)21)13(2)10-24(19)11-14-5-6-14;1-11-9-24(10-12-2-3-12)18-16(11)17(21)15(8-22-18)19(25)23-14-6-4-13(20)5-7-14/h6-9,16-17,19H,4-5,10-15H2,1-3H3;4-7,14-15,17H,3,8-13H2,1-2H3,(H,27,30);3-6,13-14,16H,7-12H2,1-2H3,(H,26,29);3-4,7-10,14H,5-6,11H2,1-2H3,(H,23,25);4-9,12H,2-3,10H2,1H3,(H,23,25).
What are the key properties of 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide?
4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 2020.04 g/mol, XLogP of 24.61, 26 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(cyclopropylmethyl)-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;7-chloro-N-ethyl-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-3-[2-(1-ethylpiperidin-4-yl)ethyl]-N-(4-methylphenyl)imidazo[4,5-b]pyridine-6-carboxamide;7-chloro-N-(4-methylphenyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 158110049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).