2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide

C21H21N3O3 — CID 71888696

IUPAC2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide
SMILESCOCCn1cc(NC(=O)c2cc(C3CC3)nc3ccccc23)ccc1=O
InChIInChI=1S/C21H21N3O3/c1-27-11-10-24-13-15(8-9-20(24)25)22-21(26)17-12-19(14-6-7-14)23-18-5-3-2-4-16(17)18/h2-5,8-9,12-14H,6-7,10-11H2,1H3,(H,22,26)
InChIKeyLSHHYLHECAJCFT-UHFFFAOYSA-N
MW363.42 g/mol
LogP3.17
Rot. Bonds6

About 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide

2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide (PubChem CID 71888696) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide
PubChem CID71888696
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC Name2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide
SMILESCOCCn1cc(NC(=O)c2cc(C3CC3)nc3ccccc23)ccc1=O
InChIInChI=1S/C21H21N3O3/c1-27-11-10-24-13-15(8-9-20(24)25)22-21(26)17-12-19(14-6-7-14)23-18-5-3-2-4-16(17)18/h2-5,8-9,12-14H,6-7,10-11H2,1H3,(H,22,26)
InChIKeyLSHHYLHECAJCFT-UHFFFAOYSA-N
XLogP3.17
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]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

methyl N-[4-[(2-cyclopropylquinoline-4-carbonyl)amino]phenyl]-N-methylcarbamate
CID 60578469
N-[4-(cyclopropanecarbonylamino)phenyl]-2-cyclopropylquinoline-4-carboxamide
CID 30456130
2-cyclopropyl-N-pyridin-3-ylquinoline-4-carboxamide
CID 31745720
[2-(4-methoxyanilino)-2-oxoethyl] 2-cyclopropylquinoline-4-carboxylate
CID 40763723
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-4-methylthiophene-3-carboxamide
CID 71968599
2,5-dibromo-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]thiophene-3-carboxamide
CID 103776755
2-cyclopropyl-N-methylsulfonylquinoline-4-carboxamide
CID 146154924
2-cyclopropyl-N-[(3,4,5-trimethoxyphenyl)methyl]quinoline-4-carboxamide
CID 9483435
2-cyclopropyl-N-(3-nitrophenyl)quinoline-4-carboxamide
CID 9040689
2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide
CID 51083364
(2S)-2-[(2-cyclopropylquinoline-4-carbonyl)amino]-3-methylbutanoic acid
CID 119360414
2-cyclopentylquinoline-4-carbohydrazide
CID 5270704

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide (CID 71888696) is 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide is COCCn1cc(NC(=O)c2cc(C3CC3)nc3ccccc23)ccc1=O.
What is the InChIKey of 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide?
The InChIKey is LSHHYLHECAJCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c1-27-11-10-24-13-15(8-9-20(24)25)22-21(26)17-12-19(14-6-7-14)23-18-5-3-2-4-16(17)18/h2-5,8-9,12-14H,6-7,10-11H2,1H3,(H,22,26).
What are the key properties of 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide?
2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]quinoline-4-carboxamide is sourced from PubChem (CID 71888696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).