2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide

C15H19F2NO — CID 134046668

IUPAC2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccc(F)cc1F)C(=O)CC1CCCC1
InChIInChI=1S/C15H19F2NO/c1-18(15(19)8-11-4-2-3-5-11)10-12-6-7-13(16)9-14(12)17/h6-7,9,11H,2-5,8,10H2,1H3
InChIKeyCPRLADYAPNHPSR-UHFFFAOYSA-N
MW267.32 g/mol
LogP3.50
Rot. Bonds4

About 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide

2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide (PubChem CID 134046668) has the molecular formula C15H19F2NO and a molecular weight of 267.32 g/mol. Its IUPAC name is 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide
PubChem CID134046668
Molecular FormulaC15H19F2NO
Molecular Weight267.32 g/mol
Exact Mass267.14
IUPAC Name2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccc(F)cc1F)C(=O)CC1CCCC1
InChIInChI=1S/C15H19F2NO/c1-18(15(19)8-11-4-2-3-5-11)10-12-6-7-13(16)9-14(12)17/h6-7,9,11H,2-5,8,10H2,1H3
InChIKeyCPRLADYAPNHPSR-UHFFFAOYSA-N
XLogP3.50
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(2,4-difluorophenyl)methyl-methylamino]-3-oxopropanoic acid
CID 55049729
1-cycloheptyl-3-(2,4-difluorophenyl)propan-2-one
CID 114458081
N-[(2,4-difluorophenyl)methyl]-N-methyl-2-oxoacetamide
CID 115166392
2-[1-(aminomethyl)cyclobutyl]-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide
CID 81172216
N-[(2,4-difluorophenyl)methyl]-2-(2-fluorophenyl)-N-methylacetamide
CID 134046604
5-[(2,4-difluorophenyl)methyl-methylamino]-5-oxopentanoic acid
CID 54874892
ethyl N-[(2,4-difluorophenyl)methyl]-N-methylcarbamate
CID 60725198
3-amino-N-[(2,4-difluorophenyl)methyl]-N-methylbutanamide;hydrochloride
CID 119703011
N-[(2-bromophenyl)methyl]-2-cycloheptyl-N-methylacetamide
CID 114457955
N-[(5-amino-2-chlorophenyl)methyl]-2-cycloheptyl-N-methylacetamide
CID 114457040
[2-[(2-fluorophenyl)methyl-methylamino]-2-oxoethyl] 2-cyclopentylacetate
CID 55397003
N-[(2,4-difluorophenyl)methyl]-N,2,2-trimethylpropanamide
CID 60725238

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide?
The IUPAC name of 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide (CID 134046668) is 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide is CN(Cc1ccc(F)cc1F)C(=O)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide?
The InChIKey is CPRLADYAPNHPSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2NO/c1-18(15(19)8-11-4-2-3-5-11)10-12-6-7-13(16)9-14(12)17/h6-7,9,11H,2-5,8,10H2,1H3.
What are the key properties of 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide?
2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide has a molecular weight of 267.32 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[(2,4-difluorophenyl)methyl]-N-methylacetamide is sourced from PubChem (CID 134046668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).