4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one

C18H16ClN5O2 — CID 70770683

IUPAC4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one
SMILESCn1c(-c2ccccc2Cl)nc2cc(C(=O)N3CCNC(=O)C3)cnc21
InChIInChI=1S/C18H16ClN5O2/c1-23-16(12-4-2-3-5-13(12)19)22-14-8-11(9-21-17(14)23)18(26)24-7-6-20-15(25)10-24/h2-5,8-9H,6-7,10H2,1H3,(H,20,25)
InChIKeyVFEPSSYQNSHPNJ-UHFFFAOYSA-N
MW369.81 g/mol
LogP1.86
Rot. Bonds2

About 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one

4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one (PubChem CID 70770683) has the molecular formula C18H16ClN5O2 and a molecular weight of 369.81 g/mol. Its IUPAC name is 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one.

Molecular Properties

Compound Name4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one
PubChem CID70770683
Molecular FormulaC18H16ClN5O2
Molecular Weight369.81 g/mol
Exact Mass369.10
IUPAC Name4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one
SMILESCn1c(-c2ccccc2Cl)nc2cc(C(=O)N3CCNC(=O)C3)cnc21
InChIInChI=1S/C18H16ClN5O2/c1-23-16(12-4-2-3-5-13(12)19)22-14-8-11(9-21-17(14)23)18(26)24-7-6-20-15(25)10-24/h2-5,8-9H,6-7,10H2,1H3,(H,20,25)
InChIKeyVFEPSSYQNSHPNJ-UHFFFAOYSA-N
XLogP1.86
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.81
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one with MolForge

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Related Compounds

[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridin-6-yl]-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)methanone
CID 70758004
2-(2-chlorophenyl)-N-ethyl-N,3-dimethylimidazo[4,5-b]pyridine-6-carboxamide
CID 70735389
2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 70783723
2-(2-chlorophenyl)-N,3-dimethyl-N-propylimidazo[4,5-b]pyridine-6-carboxamide
CID 70725218
2-(2-chlorophenyl)-N-ethyl-3-methyl-N-propylimidazo[4,5-b]pyridine-6-carboxamide
CID 70769765
2-(2-chlorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 70741479
4-[6-(3-tert-butylphenyl)naphthalene-2-carbonyl]piperazin-2-one
CID 172656930
4-(6-methylpyridine-3-carbonyl)-1,4-diazepan-2-one
CID 62896067
4-(4-amino-3,5-dichlorobenzoyl)piperazin-2-one
CID 82832628
4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one
CID 170715914
4-(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)piperazin-2-one
CID 30887321
4-tert-butyl-N-[2-methyl-3-[1-methyl-6-oxo-5-[[5-(3-oxopiperazine-1-carbonyl)-2-pyridinyl]amino]-3-pyridinyl]phenyl]benzamide
CID 24900826

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one?
The IUPAC name of 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one (CID 70770683) is 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one.
What is the SMILES notation for 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one?
The canonical SMILES for 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one is Cn1c(-c2ccccc2Cl)nc2cc(C(=O)N3CCNC(=O)C3)cnc21.
What is the InChIKey of 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one?
The InChIKey is VFEPSSYQNSHPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN5O2/c1-23-16(12-4-2-3-5-13(12)19)22-14-8-11(9-21-17(14)23)18(26)24-7-6-20-15(25)10-24/h2-5,8-9H,6-7,10H2,1H3,(H,20,25).
What are the key properties of 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one?
4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one has a molecular weight of 369.81 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-chlorophenyl)-3-methylimidazo[4,5-b]pyridine-6-carbonyl]piperazin-2-one is sourced from PubChem (CID 70770683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).