N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide

C15H14ClFN2O — CID 28933939

IUPACN-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide
SMILESCc1cc(N)ccc1NC(=O)Cc1c(F)cccc1Cl
InChIInChI=1S/C15H14ClFN2O/c1-9-7-10(18)5-6-14(9)19-15(20)8-11-12(16)3-2-4-13(11)17/h2-7H,8,18H2,1H3,(H,19,20)
InChIKeySMCVEKDUOVXKLZ-UHFFFAOYSA-N
MW292.74 g/mol
LogP3.55
Rot. Bonds3

About N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide

N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide (PubChem CID 28933939) has the molecular formula C15H14ClFN2O and a molecular weight of 292.74 g/mol. Its IUPAC name is N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide
PubChem CID28933939
Molecular FormulaC15H14ClFN2O
Molecular Weight292.74 g/mol
Exact Mass292.08
IUPAC NameN-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide
SMILESCc1cc(N)ccc1NC(=O)Cc1c(F)cccc1Cl
InChIInChI=1S/C15H14ClFN2O/c1-9-7-10(18)5-6-14(9)19-15(20)8-11-12(16)3-2-4-13(11)17/h2-7H,8,18H2,1H3,(H,19,20)
InChIKeySMCVEKDUOVXKLZ-UHFFFAOYSA-N
XLogP3.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.74
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-amino-2,5-dimethylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 103144428
N-(2-chloro-4-fluorophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 7959366
2-(2-chloro-6-fluorophenyl)-N-(2,5-dichlorophenyl)acetamide
CID 7899933
N-(2-bromo-4-chlorophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 81271848
N-(4-amino-3,5-dichlorophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 24535666
2-(2-chloro-6-fluorophenyl)-N-(2-ethylphenyl)acetamide
CID 839109
N-(4-amino-2-methylphenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045442
N-(2-bromo-4-fluorophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 28938648
N-(4-bromo-2,6-dimethylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 60795091
2-(2-chloro-6-fluorophenyl)-N-(4-methylphenyl)acetamide
CID 2112014
N-(2-bromo-5-chlorophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 81271948
N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 18121971

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide?
The IUPAC name of N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide (CID 28933939) is N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide.
What is the SMILES notation for N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide?
The canonical SMILES for N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide is Cc1cc(N)ccc1NC(=O)Cc1c(F)cccc1Cl.
What is the InChIKey of N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide?
The InChIKey is SMCVEKDUOVXKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O/c1-9-7-10(18)5-6-14(9)19-15(20)8-11-12(16)3-2-4-13(11)17/h2-7H,8,18H2,1H3,(H,19,20).
What are the key properties of N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide?
N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide has a molecular weight of 292.74 g/mol, XLogP of 3.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methylphenyl)-2-(2-chloro-6-fluorophenyl)acetamide is sourced from PubChem (CID 28933939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).