2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide

C17H23N3O — CID 62185765

IUPAC2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide
SMILESCCCC(C)NC(=O)c1cc(NCC)nc2ccccc12
InChIInChI=1S/C17H23N3O/c1-4-8-12(3)19-17(21)14-11-16(18-5-2)20-15-10-7-6-9-13(14)15/h6-7,9-12H,4-5,8H2,1-3H3,(H,18,20)(H,19,21)
InChIKeyRQZADKNDPGEIOH-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.59
Rot. Bonds6

About 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide

2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide (PubChem CID 62185765) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide
PubChem CID62185765
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide
SMILESCCCC(C)NC(=O)c1cc(NCC)nc2ccccc12
InChIInChI=1S/C17H23N3O/c1-4-8-12(3)19-17(21)14-11-16(18-5-2)20-15-10-7-6-9-13(14)15/h6-7,9-12H,4-5,8H2,1-3H3,(H,18,20)(H,19,21)
InChIKeyRQZADKNDPGEIOH-UHFFFAOYSA-N
XLogP3.59
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(ethylamino)-N-pentan-2-ylquinoline-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

2-(ethylamino)-N-(2-methylbutyl)quinoline-4-carboxamide
CID 62692096
N-hexan-3-yl-2-(methylamino)quinoline-4-carboxamide
CID 62181643
N-[(2S)-pentan-2-yl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 25337304
2-(ethylamino)-N-(2-methylbutan-2-yl)quinoline-4-carboxamide
CID 62173209
2-methyl-N-(5-methylhexan-2-yl)quinoline-4-carboxamide
CID 4877911
2-(methylamino)-N-(3-methylbutan-2-yl)quinoline-4-carboxamide
CID 62165979
N-(4-aminobutan-2-yl)-2-methylquinoline-4-carboxamide
CID 62094391
N-(2-methoxyethyl)-2-(propylamino)quinoline-4-carboxamide
CID 62170948
2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide
CID 63563758
2-methyl-N-[(2R)-4-phenylbutan-2-yl]quinoline-4-carboxamide
CID 7032720
4-[(2-propan-2-ylquinoline-4-carbonyl)amino]pentanoic acid
CID 120534876
2-(heptan-2-ylamino)quinoline-4-carboxylic acid
CID 63539339

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide (CID 62185765) is 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide is CCCC(C)NC(=O)c1cc(NCC)nc2ccccc12.
What is the InChIKey of 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide?
The InChIKey is RQZADKNDPGEIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-4-8-12(3)19-17(21)14-11-16(18-5-2)20-15-10-7-6-9-13(14)15/h6-7,9-12H,4-5,8H2,1-3H3,(H,18,20)(H,19,21).
What are the key properties of 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide?
2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 3.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 62185765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).