N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide

C18H20ClNO2 — CID 113198111

IUPACN-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)(C)c1ccc(C)cc1
InChIInChI=1S/C18H20ClNO2/c1-12-5-7-13(8-6-12)18(2,3)17(21)20-15-11-14(19)9-10-16(15)22-4/h5-11H,1-4H3,(H,20,21)
InChIKeyLIPLPYWATBKGCS-UHFFFAOYSA-N
MW317.82 g/mol
LogP4.57
Rot. Bonds4

About N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide

N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide (PubChem CID 113198111) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide
PubChem CID113198111
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)(C)c1ccc(C)cc1
InChIInChI=1S/C18H20ClNO2/c1-12-5-7-13(8-6-12)18(2,3)17(21)20-15-11-14(19)9-10-16(15)22-4/h5-11H,1-4H3,(H,20,21)
InChIKeyLIPLPYWATBKGCS-UHFFFAOYSA-N
XLogP4.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide
CID 110438702
N-(5-chloro-2-methoxyphenyl)-N'-(2,3-dimethylphenyl)-2,2-dimethylpropanediamide
CID 108968143
N-(4-chlorophenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 110438694
N-(2,5-dimethoxyphenyl)-2-methyl-2-phenylpropanamide
CID 13309485
N-(5-chloro-2-methoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47877577
N-(5-chloro-2-methoxyphenyl)-3-methoxy-3-methylbutanamide
CID 129040736
N-(5-chloro-2-methoxyphenyl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanamide
CID 4165348
N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide
CID 79770618
N-(3-chloro-2-methylphenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 110438711
1-(5-chloro-2-methoxyphenyl)-3-[(E)-2-(4-methylphenyl)ethenyl]urea
CID 108907198
N-(4-chloro-2-methylphenyl)-2-(4-fluorophenyl)-2-methylpropanamide
CID 113197436
1-(5-chloro-2-methoxyphenyl)-3-(2,4,6-trimethylphenyl)urea
CID 108875486

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide (CID 113198111) is N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide is COc1ccc(Cl)cc1NC(=O)C(C)(C)c1ccc(C)cc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide?
The InChIKey is LIPLPYWATBKGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-12-5-7-13(8-6-12)18(2,3)17(21)20-15-11-14(19)9-10-16(15)22-4/h5-11H,1-4H3,(H,20,21).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide?
N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide has a molecular weight of 317.82 g/mol, XLogP of 4.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-methyl-2-(4-methylphenyl)propanamide is sourced from PubChem (CID 113198111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).