N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide

C18H21NO3 — CID 51276940

IUPACN-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide
SMILESCOc1cc(NC(=O)CCc2cccc(C)c2)cc(OC)c1
InChIInChI=1S/C18H21NO3/c1-13-5-4-6-14(9-13)7-8-18(20)19-15-10-16(21-2)12-17(11-15)22-3/h4-6,9-12H,7-8H2,1-3H3,(H,19,20)
InChIKeyYIAVTLPZJRTPTM-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.58
Rot. Bonds6

About N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide

N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide (PubChem CID 51276940) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide
PubChem CID51276940
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide
SMILESCOc1cc(NC(=O)CCc2cccc(C)c2)cc(OC)c1
InChIInChI=1S/C18H21NO3/c1-13-5-4-6-14(9-13)7-8-18(20)19-15-10-16(21-2)12-17(11-15)22-3/h4-6,9-12H,7-8H2,1-3H3,(H,19,20)
InChIKeyYIAVTLPZJRTPTM-UHFFFAOYSA-N
XLogP3.58
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxypyrimidin-5-yl)-3-(3-methylphenyl)propanamide
CID 122301589
3-(3,4-difluorophenyl)-N-(3,5-dimethoxyphenyl)propanamide
CID 39089275
N-(3,5-dichloro-4-hydroxyphenyl)-3-(3-methylphenyl)propanamide
CID 82881123
N-(3-methoxyphenyl)-2-[3-(3-methylphenyl)propanoylamino]benzamide
CID 55456678
3-(3-methoxyphenyl)-N-(6-methyl-3-pyridinyl)propanamide
CID 112532458
N-[4-(2-chloroethyl)phenyl]-3-(3-methylphenyl)propanamide
CID 114299156
N-(3-amino-5-fluorophenyl)-3-(3-methylphenyl)propanamide
CID 107333898
tert-butyl N-[4-methoxy-2-[3-(3-methylphenyl)propanoylamino]phenyl]carbamate
CID 60556997
N-[4-[(2-cyanoacetyl)amino]phenyl]-3-(3-methylphenyl)propanamide
CID 108922603
N-(3-amino-4-methylphenyl)-3-(3-methylphenyl)propanamide
CID 62058474
3-(2,6-dimethoxyphenyl)-N-(3-methylphenyl)propanamide
CID 100789387
N-(4-carbamothioylphenyl)-3-(3-methylphenyl)propanamide
CID 62365344

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide (CID 51276940) is N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide is COc1cc(NC(=O)CCc2cccc(C)c2)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide?
The InChIKey is YIAVTLPZJRTPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13-5-4-6-14(9-13)7-8-18(20)19-15-10-16(21-2)12-17(11-15)22-3/h4-6,9-12H,7-8H2,1-3H3,(H,19,20).
What are the key properties of N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide?
N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide has a molecular weight of 299.37 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide is sourced from PubChem (CID 51276940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).