2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide

C21H18ClFN2O — CID 2441188

IUPAC2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide
SMILESO=C(CNC(c1ccccc1)c1ccccc1)Nc1ccc(F)cc1Cl
InChIInChI=1S/C21H18ClFN2O/c22-18-13-17(23)11-12-19(18)25-20(26)14-24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21,24H,14H2,(H,25,26)
InChIKeyYPDHYJAXCHGMNL-UHFFFAOYSA-N
MW368.84 g/mol
LogP4.80
Rot. Bonds6

About 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide

2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide (PubChem CID 2441188) has the molecular formula C21H18ClFN2O and a molecular weight of 368.84 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide
PubChem CID2441188
Molecular FormulaC21H18ClFN2O
Molecular Weight368.84 g/mol
Exact Mass368.11
IUPAC Name2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide
SMILESO=C(CNC(c1ccccc1)c1ccccc1)Nc1ccc(F)cc1Cl
InChIInChI=1S/C21H18ClFN2O/c22-18-13-17(23)11-12-19(18)25-20(26)14-24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21,24H,14H2,(H,25,26)
InChIKeyYPDHYJAXCHGMNL-UHFFFAOYSA-N
XLogP4.80
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.84
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloro-4-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60536996
N-(2-chlorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60537351
N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60537256
N-(2-chloro-4-methylphenyl)-2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392747
(2S)-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]propanoic acid
CID 83195208
N-(2,5-difluorophenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9393367
2-[[(4-chlorophenyl)-phenylmethyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 4858348
2-amino-N-(2-chloro-4-fluorophenyl)-2-phenylacetamide
CID 43150560
N-(2-chlorophenyl)-2-[[(1S)-1-(3-fluorophenyl)ethyl]amino]acetamide
CID 81352559
2-(2-chloro-4-fluoroanilino)-N-[(1R)-1-phenylethyl]acetamide
CID 9099533
2-[[(4-fluorophenyl)-phenylmethyl]amino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 60537329
N-(2-chloro-4-fluorophenyl)-2-(2,6-dimethylanilino)acetamide
CID 51253129

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide?
The IUPAC name of 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide (CID 2441188) is 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide is O=C(CNC(c1ccccc1)c1ccccc1)Nc1ccc(F)cc1Cl.
What is the InChIKey of 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide?
The InChIKey is YPDHYJAXCHGMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClFN2O/c22-18-13-17(23)11-12-19(18)25-20(26)14-24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21,24H,14H2,(H,25,26).
What are the key properties of 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide?
2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide has a molecular weight of 368.84 g/mol, XLogP of 4.80, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide is sourced from PubChem (CID 2441188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).