2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide

C16H17ClN2O2 — CID 60996698

IUPAC2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(C(C)(Nc2ccccc2Cl)C(N)=O)c1
InChIInChI=1S/C16H17ClN2O2/c1-16(15(18)20,11-6-5-7-12(10-11)21-2)19-14-9-4-3-8-13(14)17/h3-10,19H,1-2H3,(H2,18,20)
InChIKeyMIBFKPCUWIHSNJ-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.16
Rot. Bonds5

About 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide

2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide (PubChem CID 60996698) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound Name2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide
PubChem CID60996698
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(C(C)(Nc2ccccc2Cl)C(N)=O)c1
InChIInChI=1S/C16H17ClN2O2/c1-16(15(18)20,11-6-5-7-12(10-11)21-2)19-14-9-4-3-8-13(14)17/h3-10,19H,1-2H3,(H2,18,20)
InChIKeyMIBFKPCUWIHSNJ-UHFFFAOYSA-N
XLogP3.16
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloroanilino)-2-phenylpropanamide
CID 54891167
2-(2-chloroanilino)-2-(3-chloro-4-fluorophenyl)propanamide
CID 60996580
2-(3-methoxyanilino)-2-phenylpropanamide
CID 60990885
2-(3-hydroxyphenyl)-2-(3-methoxyanilino)propanamide
CID 60991015
2-amino-2-(3-methoxyphenyl)propanamide
CID 60795453
2,2,2-tris(3-methoxyphenyl)acetamide
CID 174763658
2-[2-(dimethylamino)ethylamino]-2-(3-methoxyphenyl)propanamide
CID 54891175
methyl 2-hydrazinyl-2-(3-methoxyphenyl)propanoate;hydrochloride
CID 155757771
(2R)-2-(3-chlorophenyl)-2-[(3-methoxyphenyl)methylamino]propanamide
CID 97238718
2-(4-chlorophenyl)-2-(2-methylanilino)propanamide
CID 60996438
N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide
CID 45000733
2-(2-chlorophenyl)-2-(2-methylanilino)propanamide
CID 60996305

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide?
The IUPAC name of 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide (CID 60996698) is 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide.
What is the SMILES notation for 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide?
The canonical SMILES for 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide is COc1cccc(C(C)(Nc2ccccc2Cl)C(N)=O)c1.
What is the InChIKey of 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide?
The InChIKey is MIBFKPCUWIHSNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-16(15(18)20,11-6-5-7-12(10-11)21-2)19-14-9-4-3-8-13(14)17/h3-10,19H,1-2H3,(H2,18,20).
What are the key properties of 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide?
2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide has a molecular weight of 304.78 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 60996698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).