1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide

C15H16N2O3 — CID 67034428

IUPAC1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide
SMILESNC(=O)c1c(O)c2ccccc2n(C2CCCC2)c1=O
InChIInChI=1S/C15H16N2O3/c16-14(19)12-13(18)10-7-3-4-8-11(10)17(15(12)20)9-5-1-2-6-9/h3-4,7-9,18H,1-2,5-6H2,(H2,16,19)
InChIKeyVGUURYWQOJXIMT-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.92
Rot. Bonds2

About 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide

1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide (PubChem CID 67034428) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide
PubChem CID67034428
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide
SMILESNC(=O)c1c(O)c2ccccc2n(C2CCCC2)c1=O
InChIInChI=1S/C15H16N2O3/c16-14(19)12-13(18)10-7-3-4-8-11(10)17(15(12)20)9-5-1-2-6-9/h3-4,7-9,18H,1-2,5-6H2,(H2,16,19)
InChIKeyVGUURYWQOJXIMT-UHFFFAOYSA-N
XLogP1.92
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide?
The IUPAC name of 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide (CID 67034428) is 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide.
What is the SMILES notation for 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide?
The canonical SMILES for 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide is NC(=O)c1c(O)c2ccccc2n(C2CCCC2)c1=O.
What is the InChIKey of 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide?
The InChIKey is VGUURYWQOJXIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c16-14(19)12-13(18)10-7-3-4-8-11(10)17(15(12)20)9-5-1-2-6-9/h3-4,7-9,18H,1-2,5-6H2,(H2,16,19).
What are the key properties of 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide?
1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.92, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-hydroxy-2-oxoquinoline-3-carboxamide is sourced from PubChem (CID 67034428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).