N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide

C24H26N2O3 — CID 3194180

IUPACN-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
SMILESCCOc1ccc2[nH]c(=O)c(CN(C(=O)c3ccccc3)C3CCCC3)cc2c1
InChIInChI=1S/C24H26N2O3/c1-2-29-21-12-13-22-18(15-21)14-19(23(27)25-22)16-26(20-10-6-7-11-20)24(28)17-8-4-3-5-9-17/h3-5,8-9,12-15,20H,2,6-7,10-11,16H2,1H3,(H,25,27)
InChIKeyCPMPYLYMBCOLIJ-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.51
Rot. Bonds6

About N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide

N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide (PubChem CID 3194180) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
PubChem CID3194180
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
SMILESCCOc1ccc2[nH]c(=O)c(CN(C(=O)c3ccccc3)C3CCCC3)cc2c1
InChIInChI=1S/C24H26N2O3/c1-2-29-21-12-13-22-18(15-21)14-19(23(27)25-22)16-26(20-10-6-7-11-20)24(28)17-8-4-3-5-9-17/h3-5,8-9,12-15,20H,2,6-7,10-11,16H2,1H3,(H,25,27)
InChIKeyCPMPYLYMBCOLIJ-UHFFFAOYSA-N
XLogP4.51
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-methylbenzamide
CID 1459156
N-cyclopropyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-methylbenzamide
CID 1457654
N-cyclopentyl-4-fluoro-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 3194140
N-cyclohexyl-4-methoxy-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1394966
1-cyclopentyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methoxyphenyl)urea
CID 3194801
1-cyclopentyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)urea
CID 1430901
1-benzyl-3-cyclohexyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]urea
CID 4193062
1-cyclohexyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)urea
CID 1430907
1-cyclopentyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea
CID 1137416
1-cyclohexyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea
CID 3172067
1-cyclohexyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylurea
CID 1430573
N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide
CID 1459162

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The IUPAC name of N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide (CID 3194180) is N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide.
What is the SMILES notation for N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The canonical SMILES for N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide is CCOc1ccc2[nH]c(=O)c(CN(C(=O)c3ccccc3)C3CCCC3)cc2c1.
What is the InChIKey of N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The InChIKey is CPMPYLYMBCOLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-2-29-21-12-13-22-18(15-21)14-19(23(27)25-22)16-26(20-10-6-7-11-20)24(28)17-8-4-3-5-9-17/h3-5,8-9,12-15,20H,2,6-7,10-11,16H2,1H3,(H,25,27).
What are the key properties of N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide has a molecular weight of 390.48 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide is sourced from PubChem (CID 3194180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).