N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide

C11H12ClF2NO — CID 103514772

IUPACN-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide
SMILESCCN(Cc1ccccc1Cl)C(=O)C(F)F
InChIInChI=1S/C11H12ClF2NO/c1-2-15(11(16)10(13)14)7-8-5-3-4-6-9(8)12/h3-6,10H,2,7H2,1H3
InChIKeyCQNQFEBGOXKXFR-UHFFFAOYSA-N
MW247.67 g/mol
LogP2.95
Rot. Bonds4

About N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide

N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide (PubChem CID 103514772) has the molecular formula C11H12ClF2NO and a molecular weight of 247.67 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide
PubChem CID103514772
Molecular FormulaC11H12ClF2NO
Molecular Weight247.67 g/mol
Exact Mass247.06
IUPAC NameN-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide
SMILESCCN(Cc1ccccc1Cl)C(=O)C(F)F
InChIInChI=1S/C11H12ClF2NO/c1-2-15(11(16)10(13)14)7-8-5-3-4-6-9(8)12/h3-6,10H,2,7H2,1H3
InChIKeyCQNQFEBGOXKXFR-UHFFFAOYSA-N
XLogP2.95
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.67
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-amino-N-[(2-chlorophenyl)methyl]-N-ethylpropanamide
CID 78973445
(2R)-2-amino-N-[(2-chlorophenyl)methyl]-N-ethyl-3,3-dimethylbutanamide
CID 103929207
3-amino-N-[(2-chlorophenyl)methyl]-N-ethylpropanamide
CID 60938834
2-amino-N-[(2-chlorophenyl)methyl]-N-ethyl-2-methylpropanamide
CID 61265237
N-[(3-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide
CID 103514771
4-chloro-N-[(2-chlorophenyl)methyl]-N-ethylbutanamide
CID 63308077
N-[1-[(2-chlorophenyl)methyl-ethylamino]-1-oxopropan-2-yl]-3-methylbenzamide
CID 112823548
N-[(2-chlorophenyl)methyl]-2-ethyl-N-methylbutanamide
CID 78768741
4-N-[(2-chlorophenyl)methyl]-1-N,1-N,4-N-triethylpiperidine-1,4-dicarboxamide
CID 55683370
N-[(2-chlorophenyl)methyl]-2-cyclopentyl-N-ethylacetamide
CID 78852823
4,5-dichloro-N-[(2-chlorophenyl)methyl]-N-ethyl-1H-pyrrole-2-carboxamide
CID 78853144
N-[(2-chlorophenyl)methyl]-N,2-dimethylpropanamide;ethane
CID 143072453

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide (CID 103514772) is N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide is CCN(Cc1ccccc1Cl)C(=O)C(F)F.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide?
The InChIKey is CQNQFEBGOXKXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClF2NO/c1-2-15(11(16)10(13)14)7-8-5-3-4-6-9(8)12/h3-6,10H,2,7H2,1H3.
What are the key properties of N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide?
N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide has a molecular weight of 247.67 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-N-ethyl-2,2-difluoroacetamide is sourced from PubChem (CID 103514772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).