N-[bis(4-fluorophenyl)methyl]-N-methylacetamide

C16H15F2NO — CID 22660932

IUPACN-[bis(4-fluorophenyl)methyl]-N-methylacetamide
SMILESCC(=O)N(C)C(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C16H15F2NO/c1-11(20)19(2)16(12-3-7-14(17)8-4-12)13-5-9-15(18)10-6-13/h3-10,16H,1-2H3
InChIKeyBOHLXKDKGFCEDJ-UHFFFAOYSA-N
MW275.30 g/mol
LogP3.53
Rot. Bonds3

About N-[bis(4-fluorophenyl)methyl]-N-methylacetamide

N-[bis(4-fluorophenyl)methyl]-N-methylacetamide (PubChem CID 22660932) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is N-[bis(4-fluorophenyl)methyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[bis(4-fluorophenyl)methyl]-N-methylacetamide
PubChem CID22660932
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC NameN-[bis(4-fluorophenyl)methyl]-N-methylacetamide
SMILESCC(=O)N(C)C(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C16H15F2NO/c1-11(20)19(2)16(12-3-7-14(17)8-4-12)13-5-9-15(18)10-6-13/h3-10,16H,1-2H3
InChIKeyBOHLXKDKGFCEDJ-UHFFFAOYSA-N
XLogP3.53
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 60794877
N-[(4-fluorophenyl)-phenylmethyl]-N-methyl-3-phenylpropanamide
CID 42935777
(2R)-2-(4-fluorophenyl)propanoic acid
CID 7005040
2,2-difluoro-N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methylacetamide
CID 124671108
(4S)-4-(4-fluorophenyl)-4-hydroxybutan-2-one
CID 93049323
CID 89318743
CID 89318743
(2R)-2-amino-N-[1-(4-fluorophenyl)ethyl]-N-methylpropanamide;hydrochloride
CID 119275395
5-(dimethylamino)-5-(4-fluorophenyl)pentan-2-one
CID 116910606
(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 95934298
dimethylamino-(4-fluorophenyl)methanol
CID 116909515
2-amino-2-(4-fluorophenyl)-N-methylacetohydrazide
CID 116848885
N-[4-(4-fluorophenyl)-4-hydroxybutyl]-N-propan-2-ylacetamide
CID 5180780

Frequently Asked Questions

What is the IUPAC name of N-[bis(4-fluorophenyl)methyl]-N-methylacetamide?
The IUPAC name of N-[bis(4-fluorophenyl)methyl]-N-methylacetamide (CID 22660932) is N-[bis(4-fluorophenyl)methyl]-N-methylacetamide.
What is the SMILES notation for N-[bis(4-fluorophenyl)methyl]-N-methylacetamide?
The canonical SMILES for N-[bis(4-fluorophenyl)methyl]-N-methylacetamide is CC(=O)N(C)C(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of N-[bis(4-fluorophenyl)methyl]-N-methylacetamide?
The InChIKey is BOHLXKDKGFCEDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c1-11(20)19(2)16(12-3-7-14(17)8-4-12)13-5-9-15(18)10-6-13/h3-10,16H,1-2H3.
What are the key properties of N-[bis(4-fluorophenyl)methyl]-N-methylacetamide?
N-[bis(4-fluorophenyl)methyl]-N-methylacetamide has a molecular weight of 275.30 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(4-fluorophenyl)methyl]-N-methylacetamide is sourced from PubChem (CID 22660932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).