N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide

C19H26N2O3 — CID 91954522

IUPACN-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide
SMILESCC1(C)CC(=O)Nc2ccc(C(=O)NCC3(CO)CCCC3)cc21
InChIInChI=1S/C19H26N2O3/c1-18(2)10-16(23)21-15-6-5-13(9-14(15)18)17(24)20-11-19(12-22)7-3-4-8-19/h5-6,9,22H,3-4,7-8,10-12H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyZHFGSJCPDAWEHB-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.59
Rot. Bonds4

About N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide

N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide (PubChem CID 91954522) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide.

Molecular Properties

Compound NameN-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide
PubChem CID91954522
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide
SMILESCC1(C)CC(=O)Nc2ccc(C(=O)NCC3(CO)CCCC3)cc21
InChIInChI=1S/C19H26N2O3/c1-18(2)10-16(23)21-15-6-5-13(9-14(15)18)17(24)20-11-19(12-22)7-3-4-8-19/h5-6,9,22H,3-4,7-8,10-12H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyZHFGSJCPDAWEHB-UHFFFAOYSA-N
XLogP2.59
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-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-[(1-methylcyclopropyl)methyl]-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102737430
N-(furan-2-ylmethyl)-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide
CID 91946269
N-[(1-ethylcyclopropyl)methyl]-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102737434
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide
CID 91946265
4-amino-3-fluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide
CID 115357758
3-hydroxy-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-methylbenzamide
CID 115993853
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 80716453
4-fluoro-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-3-methylbenzamide
CID 115701270
3-bromo-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-methylbenzamide
CID 115701184
4,4-dimethyl-6-(pyrrolidine-1-carbonyl)-1,3-dihydroquinolin-2-one
CID 100815471
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 115271278
3-hydroxy-N-[[1-(hydroxymethyl)cyclopropyl]methyl]-4-iodobenzamide
CID 113434894

Frequently Asked Questions

What is the IUPAC name of N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide?
The IUPAC name of N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide (CID 91954522) is N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide.
What is the SMILES notation for N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide?
The canonical SMILES for N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide is CC1(C)CC(=O)Nc2ccc(C(=O)NCC3(CO)CCCC3)cc21.
What is the InChIKey of N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide?
The InChIKey is ZHFGSJCPDAWEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-18(2)10-16(23)21-15-6-5-13(9-14(15)18)17(24)20-11-19(12-22)7-3-4-8-19/h5-6,9,22H,3-4,7-8,10-12H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide?
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.59, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(hydroxymethyl)cyclopentyl]methyl]-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-carboxamide is sourced from PubChem (CID 91954522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).