N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide

C15H18N2O2 — CID 137259158

IUPACN-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide
SMILESCCCCC(=O)/N=C1\C=CC2C(C)=CC(=O)NC2=C1
InChIInChI=1S/C15H18N2O2/c1-3-4-5-14(18)16-11-6-7-12-10(2)8-15(19)17-13(12)9-11/h6-9,12H,3-5H2,1-2H3,(H,17,19)/b16-11+
InChIKeyCMAHCYSKUPQKBN-LFIBNONCSA-N
MW258.32 g/mol
LogP2.29
Rot. Bonds3

About N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide

N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide (PubChem CID 137259158) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide.

Molecular Properties

Compound NameN-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide
PubChem CID137259158
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide
SMILESCCCCC(=O)/N=C1\C=CC2C(C)=CC(=O)NC2=C1
InChIInChI=1S/C15H18N2O2/c1-3-4-5-14(18)16-11-6-7-12-10(2)8-15(19)17-13(12)9-11/h6-9,12H,3-5H2,1-2H3,(H,17,19)/b16-11+
InChIKeyCMAHCYSKUPQKBN-LFIBNONCSA-N
XLogP2.29
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide 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

2-methyl-N-(2-methyl-4a,5-dihydroquinolin-6-yl)prop-2-enamide
CID 164030875
N-(3,4-dimethyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)cyclopropanecarboxamide
CID 137258008
1-acetyl-N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)piperidine-4-carboxamide
CID 137259155
N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)butanamide
CID 137259156
2-methyl-N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)propanamide
CID 137259157
3-methyl-N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)butanamide
CID 137259159
3,3-dimethyl-N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)butanamide
CID 137259160
2-ethyl-N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)butanamide
CID 137259161
N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)-2-propylpentanamide
CID 137259162
N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)cyclopentanecarboxamide
CID 137259163
N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)cyclohexanecarboxamide
CID 137259164
2-cyclohexyl-N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)acetamide
CID 137259165

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide?
The IUPAC name of N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide (CID 137259158) is N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide.
What is the SMILES notation for N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide?
The canonical SMILES for N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide is CCCCC(=O)/N=C1\C=CC2C(C)=CC(=O)NC2=C1.
What is the InChIKey of N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide?
The InChIKey is CMAHCYSKUPQKBN-LFIBNONCSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-4-5-14(18)16-11-6-7-12-10(2)8-15(19)17-13(12)9-11/h6-9,12H,3-5H2,1-2H3,(H,17,19)/b16-11+.
What are the key properties of N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide?
N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide has a molecular weight of 258.32 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-oxo-1,4a-dihydroquinolin-7-ylidene)pentanamide is sourced from PubChem (CID 137259158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).