N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide

C16H18N2O3 — CID 57402999

IUPACN-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(=O)c2cccc(O)c2[nH]1
InChIInChI=1S/C16H18N2O3/c19-13-8-4-7-11-14(20)9-12(18-15(11)13)16(21)17-10-5-2-1-3-6-10/h4,7-10,19H,1-3,5-6H2,(H,17,21)(H,18,20)
InChIKeyKXTICVBWMNMKMM-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.30
Rot. Bonds2

About N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide

N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide (PubChem CID 57402999) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide
PubChem CID57402999
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(=O)c2cccc(O)c2[nH]1
InChIInChI=1S/C16H18N2O3/c19-13-8-4-7-11-14(20)9-12(18-15(11)13)16(21)17-10-5-2-1-3-6-10/h4,7-10,19H,1-3,5-6H2,(H,17,21)(H,18,20)
InChIKeyKXTICVBWMNMKMM-UHFFFAOYSA-N
XLogP2.30
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide 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 N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
The IUPAC name of N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide (CID 57402999) is N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
The canonical SMILES for N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide is O=C(NC1CCCCC1)c1cc(=O)c2cccc(O)c2[nH]1.
What is the InChIKey of N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
The InChIKey is KXTICVBWMNMKMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-13-8-4-7-11-14(20)9-12(18-15(11)13)16(21)17-10-5-2-1-3-6-10/h4,7-10,19H,1-3,5-6H2,(H,17,21)(H,18,20).
What are the key properties of N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.30, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide is sourced from PubChem (CID 57402999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).