N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide

C17H20N4O2 — CID 75361147

IUPACN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide
SMILESCCn1ccc(C(=O)Nc2ccc3c(c2)C(C)(C)CC(=O)N3)n1
InChIInChI=1S/C17H20N4O2/c1-4-21-8-7-14(20-21)16(23)18-11-5-6-13-12(9-11)17(2,3)10-15(22)19-13/h5-9H,4,10H2,1-3H3,(H,18,23)(H,19,22)
InChIKeyAEJBBYZXZDSQRE-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.78
Rot. Bonds3

About N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide

N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide (PubChem CID 75361147) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide
PubChem CID75361147
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC NameN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide
SMILESCCn1ccc(C(=O)Nc2ccc3c(c2)C(C)(C)CC(=O)N3)n1
InChIInChI=1S/C17H20N4O2/c1-4-21-8-7-14(20-21)16(23)18-11-5-6-13-12(9-11)17(2,3)10-15(22)19-13/h5-9H,4,10H2,1-3H3,(H,18,23)(H,19,22)
InChIKeyAEJBBYZXZDSQRE-UHFFFAOYSA-N
XLogP2.78
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-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

Related Compounds

N-(3-acetamidophenyl)-1-ethylpyrazole-3-carboxamide
CID 6470772
1-ethyl-N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)pyrazole-3-carboxamide
CID 71842967
N-(3-bromophenyl)-1-ethylpyrazole-3-carboxamide
CID 6466747
N-(4-carbamoylphenyl)-1-ethylpyrazole-3-carboxamide
CID 6469151
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)cyclobutanecarboxamide
CID 75361169
1-ethyl-N-[4-[(2-methoxyacetyl)amino]phenyl]pyrazole-3-carboxamide
CID 131908281
3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide
CID 75361156
1-ethyl-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)pyrazole-3-carboxamide
CID 95752902
N-(5-chloro-2-hydroxyphenyl)-1-ethylpyrazole-3-carboxamide
CID 19262175
propyl 4-[(1-ethylpyrazole-3-carbonyl)amino]benzoate
CID 19580076
N,1-diethylpyrazole-3-carboxamide
CID 19262384
N-[2-(1-ethylpyrazole-3-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-2-carboxamide
CID 72891891

Frequently Asked Questions

What is the IUPAC name of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide?
The IUPAC name of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide (CID 75361147) is N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide.
What is the SMILES notation for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide?
The canonical SMILES for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide is CCn1ccc(C(=O)Nc2ccc3c(c2)C(C)(C)CC(=O)N3)n1.
What is the InChIKey of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide?
The InChIKey is AEJBBYZXZDSQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-4-21-8-7-14(20-21)16(23)18-11-5-6-13-12(9-11)17(2,3)10-15(22)19-13/h5-9H,4,10H2,1-3H3,(H,18,23)(H,19,22).
What are the key properties of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide?
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)-1-ethylpyrazole-3-carboxamide is sourced from PubChem (CID 75361147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).