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

C15H16N2O3 — CID 57394279

IUPACN-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc(=O)c2cccc(O)c2[nH]1
InChIInChI=1S/C15H16N2O3/c18-12-7-3-6-10-13(19)8-11(17-14(10)12)15(20)16-9-4-1-2-5-9/h3,6-9,18H,1-2,4-5H2,(H,16,20)(H,17,19)
InChIKeyMQFIAFWZFHOGAY-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.91
Rot. Bonds2

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

N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide (PubChem CID 57394279) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide
PubChem CID57394279
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc(=O)c2cccc(O)c2[nH]1
InChIInChI=1S/C15H16N2O3/c18-12-7-3-6-10-13(19)8-11(17-14(10)12)15(20)16-9-4-1-2-5-9/h3,6-9,18H,1-2,4-5H2,(H,16,20)(H,17,19)
InChIKeyMQFIAFWZFHOGAY-UHFFFAOYSA-N
XLogP1.91
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
The IUPAC name of N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide (CID 57394279) is N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
The canonical SMILES for N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide is O=C(NC1CCCC1)c1cc(=O)c2cccc(O)c2[nH]1.
What is the InChIKey of N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
The InChIKey is MQFIAFWZFHOGAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c18-12-7-3-6-10-13(19)8-11(17-14(10)12)15(20)16-9-4-1-2-5-9/h3,6-9,18H,1-2,4-5H2,(H,16,20)(H,17,19).
What are the key properties of N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide?
N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.91, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-8-hydroxy-4-oxo-1H-quinoline-2-carboxamide is sourced from PubChem (CID 57394279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).