N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide

C16H15Cl2FN2O — CID 9336002

IUPACN-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide
SMILESC[C@@H](NCC(=O)Nc1ccc(Cl)cc1F)c1ccc(Cl)cc1
InChIInChI=1S/C16H15Cl2FN2O/c1-10(11-2-4-12(17)5-3-11)20-9-16(22)21-15-7-6-13(18)8-14(15)19/h2-8,10,20H,9H2,1H3,(H,21,22)/t10-/m1/s1
InChIKeyVVMLCDOSVAQPAN-SNVBAGLBSA-N
MW341.21 g/mol
LogP4.42
Rot. Bonds5

About N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide

N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide (PubChem CID 9336002) has the molecular formula C16H15Cl2FN2O and a molecular weight of 341.21 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide
PubChem CID9336002
Molecular FormulaC16H15Cl2FN2O
Molecular Weight341.21 g/mol
Exact Mass340.05
IUPAC NameN-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide
SMILESC[C@@H](NCC(=O)Nc1ccc(Cl)cc1F)c1ccc(Cl)cc1
InChIInChI=1S/C16H15Cl2FN2O/c1-10(11-2-4-12(17)5-3-11)20-9-16(22)21-15-7-6-13(18)8-14(15)19/h2-8,10,20H,9H2,1H3,(H,21,22)/t10-/m1/s1
InChIKeyVVMLCDOSVAQPAN-SNVBAGLBSA-N
XLogP4.42
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.21
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-N-(2,5-dichlorophenyl)acetamide
CID 9335626
(2S)-2-[[2-(4-chloro-2-fluoroanilino)-2-oxoethyl]amino]propanoic acid
CID 83193996
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-N-(3,4-difluorophenyl)acetamide
CID 9335587
N-(2-fluoro-4-methylphenyl)-2-[[(1R)-1-phenylethyl]amino]acetamide
CID 8898768
N-(4-chlorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide
CID 9336008
N-(4-bromo-2-fluorophenyl)-2-[[(1R)-1-(3,4-difluorophenyl)ethyl]amino]acetamide
CID 9376424
N-(5-chloro-2-nitrophenyl)-2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]acetamide
CID 9336439
[2-(4-chloro-2-fluoroanilino)-2-oxoethyl]-[(1R)-1-(4-chlorophenyl)ethyl]azanium
CID 9336001
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-N-(3-fluorophenyl)acetamide
CID 9336360
2-[[(1S)-1-(4-bromophenyl)propyl]amino]-N-(4-chloro-2-fluorophenyl)acetamide
CID 9263707
2-[1-(4-chlorophenyl)ethylamino]-N-methylacetamide
CID 43214679
N-(2-acetylphenyl)-2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]acetamide
CID 9336592

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide (CID 9336002) is N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide is C[C@@H](NCC(=O)Nc1ccc(Cl)cc1F)c1ccc(Cl)cc1.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide?
The InChIKey is VVMLCDOSVAQPAN-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H15Cl2FN2O/c1-10(11-2-4-12(17)5-3-11)20-9-16(22)21-15-7-6-13(18)8-14(15)19/h2-8,10,20H,9H2,1H3,(H,21,22)/t10-/m1/s1.
What are the key properties of N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide?
N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide has a molecular weight of 341.21 g/mol, XLogP of 4.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide is sourced from PubChem (CID 9336002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).