4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine

C27H26N10O2 — CID 143403180

IUPAC4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine
SMILESNC(=O)N1CCC(n2c(=O)[nH]c3ncccc32)CC1.c1ccc(C2=NCc3nnnn3-c3ccccc32)cc1
InChIInChI=1S/C15H11N5.C12H15N5O2/c1-2-6-11(7-3-1)15-12-8-4-5-9-13(12)20-14(10-16-15)17-18-19-20;13-11(18)16-6-3-8(4-7-16)17-9-2-1-5-14-10(9)15-12(17)19/h1-9H,10H2;1-2,5,8H,3-4,6-7H2,(H2,13,18)(H,14,15,19)
InChIKeyJPQKHQLEAUDXBW-UHFFFAOYSA-N
MW522.57 g/mol
LogP2.45
Rot. Bonds2

About 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine

4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine (PubChem CID 143403180) has the molecular formula C27H26N10O2 and a molecular weight of 522.57 g/mol. Its IUPAC name is 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine.

Molecular Properties

Compound Name4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine
PubChem CID143403180
Molecular FormulaC27H26N10O2
Molecular Weight522.57 g/mol
Exact Mass522.22
IUPAC Name4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine
SMILESNC(=O)N1CCC(n2c(=O)[nH]c3ncccc32)CC1.c1ccc(C2=NCc3nnnn3-c3ccccc32)cc1
InChIInChI=1S/C15H11N5.C12H15N5O2/c1-2-6-11(7-3-1)15-12-8-4-5-9-13(12)20-14(10-16-15)17-18-19-20;13-11(18)16-6-3-8(4-7-16)17-9-2-1-5-14-10(9)15-12(17)19/h1-9H,10H2;1-2,5,8H,3-4,6-7H2,(H2,13,18)(H,14,15,19)
InChIKeyJPQKHQLEAUDXBW-UHFFFAOYSA-N
XLogP2.45
TPSA152.97 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500522.57
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine with MolForge

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

Launch Full Analysis

Related Compounds

potassium;hydride;4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CID 174628574
ethyl 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxylate
CID 24885297
methylidyne-[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]azanium
CID 163491141
potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 145302216
methyl 4-[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidin-1-yl]piperidine-1-carboxylate
CID 22745299
ethane;4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbaldehyde
CID 142441053
ethane;1-(1-methylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 143218186
1-[1-[2-[4-amino-5-(2,3-dichlorophenyl)pyrrolo[2,3-d]pyrimidin-7-yl]acetyl]piperidin-4-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 68877072
2-[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 58386658
1-[1-(4-aminophenyl)piperidin-4-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 118888622
N-[5-(2-fluorophenyl)-2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CID 11848965
1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one
CID 175822352

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine?
The IUPAC name of 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine (CID 143403180) is 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine.
What is the SMILES notation for 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine?
The canonical SMILES for 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine is NC(=O)N1CCC(n2c(=O)[nH]c3ncccc32)CC1.c1ccc(C2=NCc3nnnn3-c3ccccc32)cc1.
What is the InChIKey of 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine?
The InChIKey is JPQKHQLEAUDXBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5.C12H15N5O2/c1-2-6-11(7-3-1)15-12-8-4-5-9-13(12)20-14(10-16-15)17-18-19-20;13-11(18)16-6-3-8(4-7-16)17-9-2-1-5-14-10(9)15-12(17)19/h1-9H,10H2;1-2,5,8H,3-4,6-7H2,(H2,13,18)(H,14,15,19).
What are the key properties of 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine?
4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine has a molecular weight of 522.57 g/mol, XLogP of 2.45, 2 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide;6-phenyl-4H-tetrazolo[1,5-a][1,4]benzodiazepine is sourced from PubChem (CID 143403180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).