2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one

C10H12ClNO — CID 82282086

IUPAC2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one
SMILESCC(C)(N)C(=O)c1ccccc1Cl
InChIInChI=1S/C10H12ClNO/c1-10(2,12)9(13)7-5-3-4-6-8(7)11/h3-6H,12H2,1-2H3
InChIKeyOHDUCFDDNJNTKB-UHFFFAOYSA-N
MW197.67 g/mol
LogP2.26
Rot. Bonds2

About 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one

2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one (PubChem CID 82282086) has the molecular formula C10H12ClNO and a molecular weight of 197.67 g/mol. Its IUPAC name is 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one.

Molecular Properties

Compound Name2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one
PubChem CID82282086
Molecular FormulaC10H12ClNO
Molecular Weight197.67 g/mol
Exact Mass197.06
IUPAC Name2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one
SMILESCC(C)(N)C(=O)c1ccccc1Cl
InChIInChI=1S/C10H12ClNO/c1-10(2,12)9(13)7-5-3-4-6-8(7)11/h3-6H,12H2,1-2H3
InChIKeyOHDUCFDDNJNTKB-UHFFFAOYSA-N
XLogP2.26
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.67
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dichloro-1-(2-chlorophenyl)-3,3-dimethylbutan-1-one
CID 19347636
2-amino-1-(2-chlorophenyl)-2-methylpentan-1-one
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ethyl 3-(2-chlorophenyl)-2,2-dimethyl-3-oxopropanoate
CID 22664966
1-(2-chlorophenyl)-2-(ethylamino)-2-methylpropan-1-one
CID 97356118
2-amino-3-(2,3-dichlorophenyl)-2-methyl-3-oxopropanoic acid
CID 68607874
N-(2-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride
CID 119630194
1-(2-chlorophenyl)-2-methoxy-2-methylbutan-1-one
CID 116746687
1-(2-chlorophenyl)ethanone;hydrochloride
CID 174743581
1-(2-chlorophenyl)-2-(dimethylamino)-2-ethylbutan-1-one
CID 79062329
(2-tert-butylphenyl)-(2-chlorophenyl)methanone
CID 14145194
2-amino-1-(1-benzofuran-3-yl)-2-methylpropan-1-one
CID 116915418
2-chlorobenzoyl chloride;iron;1,2-xylene
CID 174484183

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one?
The IUPAC name of 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one (CID 82282086) is 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one.
What is the SMILES notation for 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one?
The canonical SMILES for 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one is CC(C)(N)C(=O)c1ccccc1Cl.
What is the InChIKey of 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one?
The InChIKey is OHDUCFDDNJNTKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO/c1-10(2,12)9(13)7-5-3-4-6-8(7)11/h3-6H,12H2,1-2H3.
What are the key properties of 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one?
2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one has a molecular weight of 197.67 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-chlorophenyl)-2-methylpropan-1-one is sourced from PubChem (CID 82282086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).