3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide

C14H16N2O2 — CID 170238348

IUPAC3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide
SMILESCc1c(C(=O)NC(C)C)c2ccccc2[nH]c1=O
InChIInChI=1S/C14H16N2O2/c1-8(2)15-14(18)12-9(3)13(17)16-11-7-5-4-6-10(11)12/h4-8H,1-3H3,(H,15,18)(H,16,17)
InChIKeyDDJBRBZIJUZANK-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.97
Rot. Bonds2

About 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide

3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide (PubChem CID 170238348) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide.

Molecular Properties

Compound Name3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide
PubChem CID170238348
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide
SMILESCc1c(C(=O)NC(C)C)c2ccccc2[nH]c1=O
InChIInChI=1S/C14H16N2O2/c1-8(2)15-14(18)12-9(3)13(17)16-11-7-5-4-6-10(11)12/h4-8H,1-3H3,(H,15,18)(H,16,17)
InChIKeyDDJBRBZIJUZANK-UHFFFAOYSA-N
XLogP1.97
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one
CID 131849523
4-hydroxy-2-oxo-N-(1-phenylethyl)-1H-quinoline-3-carboxamide
CID 54677764
3-methyl-4-propan-2-yl-1H-quinolin-2-one
CID 70906749
3-acetyl-4-methyl-1H-quinolin-2-one
CID 102153269
4-methyl-2-oxo-N-phenyl-1H-quinoline-3-carboxamide
CID 24951306
ethane;4-hydroxy-3-methyl-1H-quinolin-2-one
CID 142092755
N-[(2S)-2-cyanopropyl]-4-methyl-2-oxo-1H-quinoline-3-carboxamide
CID 96528870
N-[(1-hydroxycyclobutyl)methyl]-4-methyl-2-oxo-1H-quinoline-3-carboxamide
CID 111779687
3-methyl-4-[(2-methyl-1H-indole-3-carbonyl)amino]butanoic acid
CID 81063960
N-[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]phenyl]-3-methyl-2-oxo-1H-quinoline-4-carboxamide
CID 146076678
ethyl 2-oxo-4-propan-2-yl-1H-quinoline-3-carboxylate
CID 15722478
5-[(2-methyl-1H-indole-3-carbonyl)amino]hexanoic acid
CID 82845531

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide?
The IUPAC name of 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide (CID 170238348) is 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide.
What is the SMILES notation for 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide?
The canonical SMILES for 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide is Cc1c(C(=O)NC(C)C)c2ccccc2[nH]c1=O.
What is the InChIKey of 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide?
The InChIKey is DDJBRBZIJUZANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-8(2)15-14(18)12-9(3)13(17)16-11-7-5-4-6-10(11)12/h4-8H,1-3H3,(H,15,18)(H,16,17).
What are the key properties of 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide?
3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide is sourced from PubChem (CID 170238348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).