2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide

C9H8ClF3N2O — CID 43707397

IUPAC2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide
SMILESNCC(=O)Nc1ccc(C(F)(F)F)cc1Cl
InChIInChI=1S/C9H8ClF3N2O/c10-6-3-5(9(11,12)13)1-2-7(6)15-8(16)4-14/h1-3H,4,14H2,(H,15,16)
InChIKeyJVPVMCXDHPUAAQ-UHFFFAOYSA-N
MW252.62 g/mol
LogP2.26
Rot. Bonds2

About 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide

2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide (PubChem CID 43707397) has the molecular formula C9H8ClF3N2O and a molecular weight of 252.62 g/mol. Its IUPAC name is 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide
PubChem CID43707397
Molecular FormulaC9H8ClF3N2O
Molecular Weight252.62 g/mol
Exact Mass252.03
IUPAC Name2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide
SMILESNCC(=O)Nc1ccc(C(F)(F)F)cc1Cl
InChIInChI=1S/C9H8ClF3N2O/c10-6-3-5(9(11,12)13)1-2-7(6)15-8(16)4-14/h1-3H,4,14H2,(H,15,16)
InChIKeyJVPVMCXDHPUAAQ-UHFFFAOYSA-N
XLogP2.26
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.62
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-chloro-4-(trifluoromethyl)phenyl]-2-iodoacetamide
CID 166140537
4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]butanamide
CID 60723512
N-[2-chloro-4-(trifluoromethyl)phenyl]-2-phenylacetamide
CID 17102273
2-[(2-aminoacetyl)amino]-5-(trifluoromethyl)benzoic acid
CID 66270672
2-chloro-N-[[2-chloro-4-(trifluoromethyl)phenyl]carbamoyl]acetamide
CID 63669317
N-[2-chloro-4-(trifluoromethyl)phenyl]-3-(ethylamino)butanamide
CID 62838644
1-[2-chloro-4-(trifluoromethyl)phenyl]-2-ethylguanidine
CID 63667290
2-(2-amino-1,3-thiazol-4-yl)-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide
CID 62799070
2-amino-N-[2-(butylamino)-5-(trifluoromethyl)phenyl]acetamide
CID 119290968
2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]-4-methylpentanamide
CID 43707417
1-amino-3-[2-chloro-4-(trifluoromethyl)phenyl]-2-ethylguanidine
CID 116515184
N-[2-chloro-4-(trifluoromethyl)phenyl]-4-ethylbenzamide
CID 17102278

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide (CID 43707397) is 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide is NCC(=O)Nc1ccc(C(F)(F)F)cc1Cl.
What is the InChIKey of 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is JVPVMCXDHPUAAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClF3N2O/c10-6-3-5(9(11,12)13)1-2-7(6)15-8(16)4-14/h1-3H,4,14H2,(H,15,16).
What are the key properties of 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide?
2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 252.62 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 43707397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).