4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide

C14H20N2O3 — CID 54695777

IUPAC4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide
SMILESCCCn1c2c(c(O)c(C(=O)NC)c1=O)CCCC2
InChIInChI=1S/C14H20N2O3/c1-3-8-16-10-7-5-4-6-9(10)12(17)11(14(16)19)13(18)15-2/h17H,3-8H2,1-2H3,(H,15,18)
InChIKeyIKBBUGUTVIVBLT-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.20
Rot. Bonds3

About 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide

4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide (PubChem CID 54695777) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide
PubChem CID54695777
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide
SMILESCCCn1c2c(c(O)c(C(=O)NC)c1=O)CCCC2
InChIInChI=1S/C14H20N2O3/c1-3-8-16-10-7-5-4-6-9(10)12(17)11(14(16)19)13(18)15-2/h17H,3-8H2,1-2H3,(H,15,18)
InChIKeyIKBBUGUTVIVBLT-UHFFFAOYSA-N
XLogP1.20
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-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 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide (CID 54695777) is 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide is CCCn1c2c(c(O)c(C(=O)NC)c1=O)CCCC2.
What is the InChIKey of 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide?
The InChIKey is IKBBUGUTVIVBLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-8-16-10-7-5-4-6-9(10)12(17)11(14(16)19)13(18)15-2/h17H,3-8H2,1-2H3,(H,15,18).
What are the key properties of 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide?
4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-2-oxo-1-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide is sourced from PubChem (CID 54695777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).