2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide

C16H17FN2O — CID 108997751

IUPAC2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CNCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C16H17FN2O/c1-19(15-5-3-2-4-6-15)16(20)12-18-11-13-7-9-14(17)10-8-13/h2-10,18H,11-12H2,1H3
InChIKeyDRLWFGSZJIKXRZ-UHFFFAOYSA-N
MW272.32 g/mol
LogP2.58
Rot. Bonds5

About 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide

2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide (PubChem CID 108997751) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide
PubChem CID108997751
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CNCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C16H17FN2O/c1-19(15-5-3-2-4-6-15)16(20)12-18-11-13-7-9-14(17)10-8-13/h2-10,18H,11-12H2,1H3
InChIKeyDRLWFGSZJIKXRZ-UHFFFAOYSA-N
XLogP2.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-fluorophenyl)methylamino]-N-methyl-N-propan-2-ylacetamide
CID 28581707
2-[(3,4-dimethoxyphenyl)methylamino]-N-methyl-N-phenylacetamide
CID 109003065
N-[(4-fluorophenyl)methyl]-N'-methyl-N'-phenyloxamide
CID 87039327
N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide
CID 28581599
N-methyl-N-phenyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914951
2-[2-(4-chlorophenyl)ethylamino]-N-methyl-N-phenylacetamide
CID 109002833
2-(benzylamino)-N,N-diphenylacetamide;hydrochloride
CID 68967523
2-(cyclopropylmethylamino)-N-methyl-N-phenylacetamide
CID 60842442
1-benzyl-3-[(4-fluorophenyl)methyl]-1-phenylurea
CID 108867698
2-N-[(4-fluorophenyl)methyl]-1-N-methyl-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109136072
3-[(4-methoxyphenyl)methylamino]-N-methyl-N-phenylpropanamide
CID 109022468
3-[(4-fluorophenyl)methylamino]-N,N-dimethylpropanamide
CID 60926375

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide (CID 108997751) is 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide is CN(C(=O)CNCc1ccc(F)cc1)c1ccccc1.
What is the InChIKey of 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide?
The InChIKey is DRLWFGSZJIKXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-19(15-5-3-2-4-6-15)16(20)12-18-11-13-7-9-14(17)10-8-13/h2-10,18H,11-12H2,1H3.
What are the key properties of 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide?
2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide has a molecular weight of 272.32 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 108997751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).