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

C19H23NO2 — CID 46988817

IUPACN-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide
SMILESCCC(=O)N(Cc1ccc(OC)cc1)Cc1cccc(C)c1
InChIInChI=1S/C19H23NO2/c1-4-19(21)20(14-17-7-5-6-15(2)12-17)13-16-8-10-18(22-3)11-9-16/h5-12H,4,13-14H2,1-3H3
InChIKeyQDVUYFCVPBKVIN-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.94
Rot. Bonds6

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

N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide (PubChem CID 46988817) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide
PubChem CID46988817
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide
SMILESCCC(=O)N(Cc1ccc(OC)cc1)Cc1cccc(C)c1
InChIInChI=1S/C19H23NO2/c1-4-19(21)20(14-17-7-5-6-15(2)12-17)13-16-8-10-18(22-3)11-9-16/h5-12H,4,13-14H2,1-3H3
InChIKeyQDVUYFCVPBKVIN-UHFFFAOYSA-N
XLogP3.94
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide (CID 46988817) is N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide is CCC(=O)N(Cc1ccc(OC)cc1)Cc1cccc(C)c1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide?
The InChIKey is QDVUYFCVPBKVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-19(21)20(14-17-7-5-6-15(2)12-17)13-16-8-10-18(22-3)11-9-16/h5-12H,4,13-14H2,1-3H3.
What are the key properties of N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide?
N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide has a molecular weight of 297.40 g/mol, XLogP of 3.94, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]propanamide is sourced from PubChem (CID 46988817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).