2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide

C16H16Cl2N2O — CID 60996311

IUPAC2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide
SMILESCc1ccccc1NC(C)(C(N)=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C16H16Cl2N2O/c1-10-5-3-4-6-14(10)20-16(2,15(19)21)12-9-11(17)7-8-13(12)18/h3-9,20H,1-2H3,(H2,19,21)
InChIKeyYNPFPDNMSHWYQW-UHFFFAOYSA-N
MW323.22 g/mol
LogP4.11
Rot. Bonds4

About 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide

2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide (PubChem CID 60996311) has the molecular formula C16H16Cl2N2O and a molecular weight of 323.22 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide
PubChem CID60996311
Molecular FormulaC16H16Cl2N2O
Molecular Weight323.22 g/mol
Exact Mass322.06
IUPAC Name2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide
SMILESCc1ccccc1NC(C)(C(N)=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C16H16Cl2N2O/c1-10-5-3-4-6-14(10)20-16(2,15(19)21)12-9-11(17)7-8-13(12)18/h3-9,20H,1-2H3,(H2,19,21)
InChIKeyYNPFPDNMSHWYQW-UHFFFAOYSA-N
XLogP4.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-2-(2-methylanilino)propanamide
CID 60996305
2-(4-chlorophenyl)-2-(2-methylanilino)propanamide
CID 60996438
2-(5-bromo-2-fluorophenyl)-2-(2-methylanilino)propanamide
CID 82956528
2-(2,5-dichlorophenyl)-2-(ethylamino)propanamide
CID 60787377
methyl 2-(3-chlorophenyl)-2-(2-methylanilino)propanoate
CID 60992232
2-(2-chloroanilino)-2-(3-chloro-4-fluorophenyl)propanamide
CID 60996580
2-(2-chloroanilino)-2-phenylpropanamide
CID 54891167
1-[4-chloro-2-(trifluoromethyl)phenyl]-3-(2-methylphenyl)urea
CID 108894207
1-(2,4-dichlorophenyl)-3-(2-methylphenyl)urea
CID 6470856
2-(2-chloroanilino)-2-(3-methoxyphenyl)propanamide
CID 60996698
1-(4-chloro-2-methylphenyl)-3-(2-methylphenyl)urea
CID 108894172
2-(2,4-dichlorophenyl)-2-(propan-2-ylamino)propanamide
CID 54918479

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide?
The IUPAC name of 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide (CID 60996311) is 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide?
The canonical SMILES for 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide is Cc1ccccc1NC(C)(C(N)=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide?
The InChIKey is YNPFPDNMSHWYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O/c1-10-5-3-4-6-14(10)20-16(2,15(19)21)12-9-11(17)7-8-13(12)18/h3-9,20H,1-2H3,(H2,19,21).
What are the key properties of 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide?
2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide has a molecular weight of 323.22 g/mol, XLogP of 4.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-2-(2-methylanilino)propanamide is sourced from PubChem (CID 60996311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).