N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide

C19H17N3O2 — CID 95272465

IUPACN-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide
SMILESO=C(N[C@@H]1CCCNC1=O)c1cc2ccccc2c2cccnc12
InChIInChI=1S/C19H17N3O2/c23-18(22-16-8-4-10-21-19(16)24)15-11-12-5-1-2-6-13(12)14-7-3-9-20-17(14)15/h1-3,5-7,9,11,16H,4,8,10H2,(H,21,24)(H,22,23)/t16-/m1/s1
InChIKeyZAISOUBJXPFXFP-MRXNPFEDSA-N
MW319.36 g/mol
LogP2.40
Rot. Bonds2

About N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide

N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide (PubChem CID 95272465) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide.

Molecular Properties

Compound NameN-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide
PubChem CID95272465
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC NameN-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide
SMILESO=C(N[C@@H]1CCCNC1=O)c1cc2ccccc2c2cccnc12
InChIInChI=1S/C19H17N3O2/c23-18(22-16-8-4-10-21-19(16)24)15-11-12-5-1-2-6-13(12)14-7-3-9-20-17(14)15/h1-3,5-7,9,11,16H,4,8,10H2,(H,21,24)(H,22,23)/t16-/m1/s1
InChIKeyZAISOUBJXPFXFP-MRXNPFEDSA-N
XLogP2.40
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide 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

1-N-[(3S)-2-oxopiperidin-3-yl]-2-N-[(3R)-2-oxopiperidin-3-yl]benzene-1,2-dicarboxamide
CID 26791100
N-(4-aminocyclohexyl)benzo[f]quinoline-5-carboxamide;dihydrochloride
CID 119477643
N-(1,1-dioxothiolan-3-yl)benzo[f]quinoline-5-carboxamide
CID 71895819
2-chloro-N-(2-oxopiperidin-3-yl)benzamide
CID 47478270
N-(2-oxopiperidin-3-yl)-1H-indole-3-carboxamide
CID 49149499
N-(2,6-dimethyloxan-4-yl)benzo[f]quinoline-5-carboxamide
CID 119033670
3-amino-N-(2-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 113447702
N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]benzo[f]quinoline-5-carboxamide
CID 119032835
2-[[(3S)-2-oxoazepan-3-yl]carbamoyl]benzoic acid
CID 6930768
2,3-dihydroxy-N-(2-oxopiperidin-3-yl)benzamide
CID 114344266
2-(2-methoxyanilino)-N-[(3S)-2-oxopiperidin-3-yl]pyridine-3-carboxamide
CID 95048372
4-[[(3S)-2-oxopiperidin-3-yl]carbamoyl]benzoic acid
CID 94349391

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide?
The IUPAC name of N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide (CID 95272465) is N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide.
What is the SMILES notation for N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide?
The canonical SMILES for N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide is O=C(N[C@@H]1CCCNC1=O)c1cc2ccccc2c2cccnc12.
What is the InChIKey of N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide?
The InChIKey is ZAISOUBJXPFXFP-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H17N3O2/c23-18(22-16-8-4-10-21-19(16)24)15-11-12-5-1-2-6-13(12)14-7-3-9-20-17(14)15/h1-3,5-7,9,11,16H,4,8,10H2,(H,21,24)(H,22,23)/t16-/m1/s1.
What are the key properties of N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide?
N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide has a molecular weight of 319.36 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-2-oxopiperidin-3-yl]benzo[f]quinoline-5-carboxamide is sourced from PubChem (CID 95272465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).