2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide

C16H16ClFN2O — CID 51171749

IUPAC2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide
SMILESCC(NCC(=O)Nc1ccc(F)cc1)c1ccccc1Cl
InChIInChI=1S/C16H16ClFN2O/c1-11(14-4-2-3-5-15(14)17)19-10-16(21)20-13-8-6-12(18)7-9-13/h2-9,11,19H,10H2,1H3,(H,20,21)
InChIKeyMQUOHSBBBGYUPM-UHFFFAOYSA-N
MW306.77 g/mol
LogP3.77
Rot. Bonds5

About 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide

2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide (PubChem CID 51171749) has the molecular formula C16H16ClFN2O and a molecular weight of 306.77 g/mol. Its IUPAC name is 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide
PubChem CID51171749
Molecular FormulaC16H16ClFN2O
Molecular Weight306.77 g/mol
Exact Mass306.09
IUPAC Name2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide
SMILESCC(NCC(=O)Nc1ccc(F)cc1)c1ccccc1Cl
InChIInChI=1S/C16H16ClFN2O/c1-11(14-4-2-3-5-15(14)17)19-10-16(21)20-13-8-6-12(18)7-9-13/h2-9,11,19H,10H2,1H3,(H,20,21)
InChIKeyMQUOHSBBBGYUPM-UHFFFAOYSA-N
XLogP3.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-phenylacetamide
CID 32704244
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(3,4-difluorophenyl)acetamide
CID 9306767
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(3-fluoro-4-methylphenyl)acetamide
CID 9307246
2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-N-(4-fluorophenyl)acetamide
CID 81378359
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(4-nitrophenyl)acetamide
CID 9307115
2-[1-(2-chlorophenyl)ethylamino]-N-(2,6-dichlorophenyl)acetamide
CID 18085946
N-(3-acetamidophenyl)-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 26006629
N-(5-chloro-2-fluorophenyl)-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9306583
N-(3-chloro-4-methoxyphenyl)-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9306824
2-[[(1S)-1-(2,4-difluorophenyl)ethyl]amino]-N-phenylacetamide
CID 9369815
N-(3-acetylphenyl)-2-[1-(2-chlorophenyl)ethylamino]acetamide
CID 18085927
2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 9307339

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide (CID 51171749) is 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide is CC(NCC(=O)Nc1ccc(F)cc1)c1ccccc1Cl.
What is the InChIKey of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide?
The InChIKey is MQUOHSBBBGYUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O/c1-11(14-4-2-3-5-15(14)17)19-10-16(21)20-13-8-6-12(18)7-9-13/h2-9,11,19H,10H2,1H3,(H,20,21).
What are the key properties of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide?
2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide has a molecular weight of 306.77 g/mol, XLogP of 3.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 51171749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).