N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide

C19H24F2N2O3 — CID 131910552

IUPACN-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide
SMILESCN(CC1CC(=O)N(C2CCCC2)C1)C(=O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C19H24F2N2O3/c1-22(18(25)14-6-8-16(9-7-14)26-19(20)21)11-13-10-17(24)23(12-13)15-4-2-3-5-15/h6-9,13,15,19H,2-5,10-12H2,1H3
InChIKeyGDVFUOAIMDJVEA-UHFFFAOYSA-N
MW366.41 g/mol
LogP3.15
Rot. Bonds6

About N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide

N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide (PubChem CID 131910552) has the molecular formula C19H24F2N2O3 and a molecular weight of 366.41 g/mol. Its IUPAC name is N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide.

Molecular Properties

Compound NameN-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide
PubChem CID131910552
Molecular FormulaC19H24F2N2O3
Molecular Weight366.41 g/mol
Exact Mass366.18
IUPAC NameN-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide
SMILESCN(CC1CC(=O)N(C2CCCC2)C1)C(=O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C19H24F2N2O3/c1-22(18(25)14-6-8-16(9-7-14)26-19(20)21)11-13-10-17(24)23(12-13)15-4-2-3-5-15/h6-9,13,15,19H,2-5,10-12H2,1H3
InChIKeyGDVFUOAIMDJVEA-UHFFFAOYSA-N
XLogP3.15
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-butoxy-N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-N-methylacetamide
CID 131947635
N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-N-methyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 77097540
1-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-3-[(3-methoxyphenyl)methyl]-1-methylurea
CID 126448423
N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-N,2,6-trimethylpyrimidine-4-carboxamide
CID 50960371
1-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-1-methyl-3-(3,4,5-trifluorophenyl)urea
CID 72925137
1-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-[(2,4-dichlorophenyl)methyl]-1-methylurea
CID 131949003
N-cyclohexyl-4-(difluoromethoxy)-N-ethylbenzamide
CID 78805547
4-(difluoromethoxy)-N-[[1-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]piperidin-4-yl]methyl]-N-methylbenzamide
CID 176815247
5-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl-methylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
CID 124757384
1-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-1-methyl-3-(1-methylpyrazol-4-yl)urea
CID 125167246
4-(difluoromethoxy)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methylbenzamide
CID 31975786
1-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-1-methyl-3-(2-methyl-1-benzofuran-5-yl)urea
CID 125170612

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide?
The IUPAC name of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide (CID 131910552) is N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide.
What is the SMILES notation for N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide?
The canonical SMILES for N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide is CN(CC1CC(=O)N(C2CCCC2)C1)C(=O)c1ccc(OC(F)F)cc1.
What is the InChIKey of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide?
The InChIKey is GDVFUOAIMDJVEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F2N2O3/c1-22(18(25)14-6-8-16(9-7-14)26-19(20)21)11-13-10-17(24)23(12-13)15-4-2-3-5-15/h6-9,13,15,19H,2-5,10-12H2,1H3.
What are the key properties of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide?
N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide has a molecular weight of 366.41 g/mol, XLogP of 3.15, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-(difluoromethoxy)-N-methylbenzamide is sourced from PubChem (CID 131910552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).