N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide

C18H21NO2 — CID 172554773

IUPACN-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide
SMILESCOc1ccc(N(C)C(=O)CCc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO2/c1-14-4-6-15(7-5-14)8-13-18(20)19(2)16-9-11-17(21-3)12-10-16/h4-7,9-12H,8,13H2,1-3H3
InChIKeyHPNVLLUQDNSRSI-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.60
Rot. Bonds5

About N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide

N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide (PubChem CID 172554773) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide
PubChem CID172554773
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide
SMILESCOc1ccc(N(C)C(=O)CCc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO2/c1-14-4-6-15(7-5-14)8-13-18(20)19(2)16-9-11-17(21-3)12-10-16/h4-7,9-12H,8,13H2,1-3H3
InChIKeyHPNVLLUQDNSRSI-UHFFFAOYSA-N
XLogP3.60
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide?
The IUPAC name of N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide (CID 172554773) is N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide.
What is the SMILES notation for N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide?
The canonical SMILES for N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide is COc1ccc(N(C)C(=O)CCc2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide?
The InChIKey is HPNVLLUQDNSRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-14-4-6-15(7-5-14)8-13-18(20)19(2)16-9-11-17(21-3)12-10-16/h4-7,9-12H,8,13H2,1-3H3.
What are the key properties of N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide?
N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide is sourced from PubChem (CID 172554773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).