3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide

C14H16N2O3 — CID 16745855

IUPAC3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide
SMILESCCCNC(=O)c1ccc2c(=O)c(O)c(C)[nH]c2c1
InChIInChI=1S/C14H16N2O3/c1-3-6-15-14(19)9-4-5-10-11(7-9)16-8(2)12(17)13(10)18/h4-5,7,17H,3,6H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyUUUDLVCRXOSNDI-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.68
Rot. Bonds3

About 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide

3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide (PubChem CID 16745855) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide.

Molecular Properties

Compound Name3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide
PubChem CID16745855
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide
SMILESCCCNC(=O)c1ccc2c(=O)c(O)c(C)[nH]c2c1
InChIInChI=1S/C14H16N2O3/c1-3-6-15-14(19)9-4-5-10-11(7-9)16-8(2)12(17)13(10)18/h4-5,7,17H,3,6H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyUUUDLVCRXOSNDI-UHFFFAOYSA-N
XLogP1.68
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide?
The IUPAC name of 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide (CID 16745855) is 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide.
What is the SMILES notation for 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide?
The canonical SMILES for 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide is CCCNC(=O)c1ccc2c(=O)c(O)c(C)[nH]c2c1.
What is the InChIKey of 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide?
The InChIKey is UUUDLVCRXOSNDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-3-6-15-14(19)9-4-5-10-11(7-9)16-8(2)12(17)13(10)18/h4-5,7,17H,3,6H2,1-2H3,(H,15,19)(H,16,18).
What are the key properties of 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide?
3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide has a molecular weight of 260.29 g/mol, XLogP of 1.68, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-4-oxo-N-propyl-1H-quinoline-7-carboxamide is sourced from PubChem (CID 16745855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).