5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine

C102H127Cl3N16O10P4 — CID 159167125

IUPAC5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine
SMILESCC1=Nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(CC(=O)C3CC3)nc2C1.CP(C)(=O)c1cc(C2CC2)ccc1N.Cc1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.Cc1nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(CC(=O)C3CC3)nc2n1C1CCCCO1.Cc1nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1
InChIInChI=1S/C28H35N4O3P.C24H28N3O2P.C23H28ClN4O2P.C12H13Cl2N3O.C11H16NOP.C4H7NO/c1-17-29-27-23(31-22-12-11-20(18-7-8-18)14-25(22)36(2,3)34)15-21(16-24(33)19-9-10-19)30-28(27)32(17)26-6-4-5-13-35-26;1-14-10-20-24(25-14)21(12-18(26-20)13-22(28)16-6-7-16)27-19-9-8-17(15-4-5-15)11-23(19)30(2,3)29;1-14-25-22-18(13-20(24)27-23(22)28(14)21-6-4-5-11-30-21)26-17-10-9-16(15-7-8-15)12-19(17)31(2,3)29;1-7-15-11-8(13)6-9(14)16-12(11)17(7)10-4-2-3-5-18-10;1-14(2,13)11-7-9(8-3-4-8)5-6-10(11)12;5-4(6)3-1-2-3/h11-12,14-15,18-19,26H,4-10,13,16H2,1-3H3,(H,30,31);8-9,11-12,15-16H,4-7,10,13H2,1-3H3,(H,26,27);9-10,12-13,15,21H,4-8,11H2,1-3H3,(H,26,27);6,10H,2-5H2,1H3;5-8H,3-4,12H2,1-2H3;3H,1-2H2,(H2,5,6)
InChIKeyKLFFDLXOJUNFPS-UHFFFAOYSA-N
MW1967.49 g/mol
LogP22.93
Rot. Bonds24

About 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine

5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine (PubChem CID 159167125) has the molecular formula C102H127Cl3N16O10P4 and a molecular weight of 1967.49 g/mol. Its IUPAC name is 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine
PubChem CID159167125
Molecular FormulaC102H127Cl3N16O10P4
Molecular Weight1967.49 g/mol
Exact Mass1964.79
IUPAC Name5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine
SMILESCC1=Nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(CC(=O)C3CC3)nc2C1.CP(C)(=O)c1cc(C2CC2)ccc1N.Cc1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.Cc1nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(CC(=O)C3CC3)nc2n1C1CCCCO1.Cc1nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1
InChIInChI=1S/C28H35N4O3P.C24H28N3O2P.C23H28ClN4O2P.C12H13Cl2N3O.C11H16NOP.C4H7NO/c1-17-29-27-23(31-22-12-11-20(18-7-8-18)14-25(22)36(2,3)34)15-21(16-24(33)19-9-10-19)30-28(27)32(17)26-6-4-5-13-35-26;1-14-10-20-24(25-14)21(12-18(26-20)13-22(28)16-6-7-16)27-19-9-8-17(15-4-5-15)11-23(19)30(2,3)29;1-14-25-22-18(13-20(24)27-23(22)28(14)21-6-4-5-11-30-21)26-17-10-9-16(15-7-8-15)12-19(17)31(2,3)29;1-7-15-11-8(13)6-9(14)16-12(11)17(7)10-4-2-3-5-18-10;1-14(2,13)11-7-9(8-3-4-8)5-6-10(11)12;5-4(6)3-1-2-3/h11-12,14-15,18-19,26H,4-10,13,16H2,1-3H3,(H,30,31);8-9,11-12,15-16H,4-7,10,13H2,1-3H3,(H,26,27);9-10,12-13,15,21H,4-8,11H2,1-3H3,(H,26,27);6,10H,2-5H2,1H3;5-8H,3-4,12H2,1-2H3;3H,1-2H2,(H2,5,6)
InChIKeyKLFFDLXOJUNFPS-UHFFFAOYSA-N
XLogP22.93
TPSA352.69 Ų
H-Bond Donors5
H-Bond Acceptors25
Rotatable Bonds24
Heavy Atoms135
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001967.49
LogP ≤ 522.93
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine (CID 159167125) is 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine is CC1=Nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(CC(=O)C3CC3)nc2C1.CP(C)(=O)c1cc(C2CC2)ccc1N.Cc1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.Cc1nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(CC(=O)C3CC3)nc2n1C1CCCCO1.Cc1nc2c(Nc3ccc(C4CC4)cc3P(C)(C)=O)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1.
What is the InChIKey of 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?
The InChIKey is KLFFDLXOJUNFPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N4O3P.C24H28N3O2P.C23H28ClN4O2P.C12H13Cl2N3O.C11H16NOP.C4H7NO/c1-17-29-27-23(31-22-12-11-20(18-7-8-18)14-25(22)36(2,3)34)15-21(16-24(33)19-9-10-19)30-28(27)32(17)26-6-4-5-13-35-26;1-14-10-20-24(25-14)21(12-18(26-20)13-22(28)16-6-7-16)27-19-9-8-17(15-4-5-15)11-23(19)30(2,3)29;1-14-25-22-18(13-20(24)27-23(22)28(14)21-6-4-5-11-30-21)26-17-10-9-16(15-7-8-15)12-19(17)31(2,3)29;1-7-15-11-8(13)6-9(14)16-12(11)17(7)10-4-2-3-5-18-10;1-14(2,13)11-7-9(8-3-4-8)5-6-10(11)12;5-4(6)3-1-2-3/h11-12,14-15,18-19,26H,4-10,13,16H2,1-3H3,(H,30,31);8-9,11-12,15-16H,4-7,10,13H2,1-3H3,(H,26,27);9-10,12-13,15,21H,4-8,11H2,1-3H3,(H,26,27);6,10H,2-5H2,1H3;5-8H,3-4,12H2,1-2H3;3H,1-2H2,(H2,5,6).
What are the key properties of 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?
5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine has a molecular weight of 1967.49 g/mol, XLogP of 22.93, 24 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-cyclopropyl-2-dimethylphosphorylphenyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[7-(4-cyclopropyl-2-dimethylphosphorylanilino)-2-methyl-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;4-cyclopropyl-2-dimethylphosphorylaniline;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 159167125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).