6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine

C64H78Cl7N19O7 — CID 158926837

IUPAC6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine
SMILESCn1c(=O)n(C2CCCC2)c2ncc(Cl)cc21.Cn1c(=O)n([C@@H]2CCNC2)c2ncc(Cl)cc21.NC1CCCC1.Nc1cc(Cl)cnc1NC1CCCC1.O=[N+]([O-])c1cc(Cl)cnc1Cl.O=[N+]([O-])c1cc(Cl)cnc1NC1CCCC1.O=c1[nH]c2cc(Cl)cnc2n1C1CCCC1
InChIInChI=1S/C12H14ClN3O.C11H13ClN4O.C11H12ClN3O.C10H12ClN3O2.C10H14ClN3.C5H2Cl2N2O2.C5H11N/c1-15-10-6-8(13)7-14-11(10)16(12(15)17)9-4-2-3-5-9;1-15-9-4-7(12)5-14-10(9)16(11(15)17)8-2-3-13-6-8;12-7-5-9-10(13-6-7)15(11(16)14-9)8-3-1-2-4-8;11-7-5-9(14(15)16)10(12-6-7)13-8-3-1-2-4-8;11-7-5-9(12)10(13-6-7)14-8-3-1-2-4-8;6-3-1-4(9(10)11)5(7)8-2-3;6-5-3-1-2-4-5/h6-7,9H,2-5H2,1H3;4-5,8,13H,2-3,6H2,1H3;5-6,8H,1-4H2,(H,14,16);5-6,8H,1-4H2,(H,12,13);5-6,8H,1-4,12H2,(H,13,14);1-2H;5H,1-4,6H2/t;8-;;;;;/m.1...../s1
InChIKeyJINYLHWWUPRQSP-YXZVGQBFSA-N
MW1473.62 g/mol
LogP14.77
Rot. Bonds9

About 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine

6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine (PubChem CID 158926837) has the molecular formula C64H78Cl7N19O7 and a molecular weight of 1473.62 g/mol. Its IUPAC name is 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine.

Molecular Properties

Compound Name6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine
PubChem CID158926837
Molecular FormulaC64H78Cl7N19O7
Molecular Weight1473.62 g/mol
Exact Mass1469.42
IUPAC Name6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine
SMILESCn1c(=O)n(C2CCCC2)c2ncc(Cl)cc21.Cn1c(=O)n([C@@H]2CCNC2)c2ncc(Cl)cc21.NC1CCCC1.Nc1cc(Cl)cnc1NC1CCCC1.O=[N+]([O-])c1cc(Cl)cnc1Cl.O=[N+]([O-])c1cc(Cl)cnc1NC1CCCC1.O=c1[nH]c2cc(Cl)cnc2n1C1CCCC1
InChIInChI=1S/C12H14ClN3O.C11H13ClN4O.C11H12ClN3O.C10H12ClN3O2.C10H14ClN3.C5H2Cl2N2O2.C5H11N/c1-15-10-6-8(13)7-14-11(10)16(12(15)17)9-4-2-3-5-9;1-15-9-4-7(12)5-14-10(9)16(11(15)17)8-2-3-13-6-8;12-7-5-9-10(13-6-7)15(11(16)14-9)8-3-1-2-4-8;11-7-5-9(14(15)16)10(12-6-7)13-8-3-1-2-4-8;11-7-5-9(12)10(13-6-7)14-8-3-1-2-4-8;6-3-1-4(9(10)11)5(7)8-2-3;6-5-3-1-2-4-5/h6-7,9H,2-5H2,1H3;4-5,8,13H,2-3,6H2,1H3;5-6,8H,1-4H2,(H,14,16);5-6,8H,1-4H2,(H,12,13);5-6,8H,1-4,12H2,(H,13,14);1-2H;5H,1-4,6H2/t;8-;;;;;/m.1...../s1
InChIKeyJINYLHWWUPRQSP-YXZVGQBFSA-N
XLogP14.77
TPSA343.40 Ų
H-Bond Donors6
H-Bond Acceptors23
Rotatable Bonds9
Heavy Atoms97
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001473.62
LogP ≤ 514.77
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine?
The IUPAC name of 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine (CID 158926837) is 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine.
What is the SMILES notation for 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine?
The canonical SMILES for 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine is Cn1c(=O)n(C2CCCC2)c2ncc(Cl)cc21.Cn1c(=O)n([C@@H]2CCNC2)c2ncc(Cl)cc21.NC1CCCC1.Nc1cc(Cl)cnc1NC1CCCC1.O=[N+]([O-])c1cc(Cl)cnc1Cl.O=[N+]([O-])c1cc(Cl)cnc1NC1CCCC1.O=c1[nH]c2cc(Cl)cnc2n1C1CCCC1.
What is the InChIKey of 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine?
The InChIKey is JINYLHWWUPRQSP-YXZVGQBFSA-N. The full InChI is InChI=1S/C12H14ClN3O.C11H13ClN4O.C11H12ClN3O.C10H12ClN3O2.C10H14ClN3.C5H2Cl2N2O2.C5H11N/c1-15-10-6-8(13)7-14-11(10)16(12(15)17)9-4-2-3-5-9;1-15-9-4-7(12)5-14-10(9)16(11(15)17)8-2-3-13-6-8;12-7-5-9-10(13-6-7)15(11(16)14-9)8-3-1-2-4-8;11-7-5-9(14(15)16)10(12-6-7)13-8-3-1-2-4-8;11-7-5-9(12)10(13-6-7)14-8-3-1-2-4-8;6-3-1-4(9(10)11)5(7)8-2-3;6-5-3-1-2-4-5/h6-7,9H,2-5H2,1H3;4-5,8,13H,2-3,6H2,1H3;5-6,8H,1-4H2,(H,14,16);5-6,8H,1-4H2,(H,12,13);5-6,8H,1-4,12H2,(H,13,14);1-2H;5H,1-4,6H2/t;8-;;;;;/m.1...../s1.
What are the key properties of 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine?
6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine has a molecular weight of 1473.62 g/mol, XLogP of 14.77, 9 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-cyclopentyl-1H-imidazo[4,5-b]pyridin-2-one;6-chloro-3-cyclopentyl-1-methylimidazo[4,5-b]pyridin-2-one;5-chloro-N-cyclopentyl-3-nitropyridin-2-amine;5-chloro-2-N-cyclopentylpyridine-2,3-diamine;6-chloro-1-methyl-3-[(3R)-pyrrolidin-3-yl]imidazo[4,5-b]pyridin-2-one;cyclopentanamine;2,5-dichloro-3-nitropyridine is sourced from PubChem (CID 158926837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).