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

C18H21NO — CID 139238463

IUPACN-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide
SMILESCCC(=O)N(Cc1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C18H21NO/c1-4-18(20)19(17-11-7-15(3)8-12-17)13-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3
InChIKeyUXPYSJJVNAUXCD-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.25
Rot. Bonds4

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

N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 139238463) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide
PubChem CID139238463
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide
SMILESCCC(=O)N(Cc1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C18H21NO/c1-4-18(20)19(17-11-7-15(3)8-12-17)13-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3
InChIKeyUXPYSJJVNAUXCD-UHFFFAOYSA-N
XLogP4.25
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]phenyl]-N-[(4-methylphenyl)methyl]propanamide
CID 46046700
N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 110360399
N-[(4-methylphenyl)methyl]-N-[4-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]phenyl]propanamide
CID 46052427
2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide
CID 39443965
N-[(4-methylphenyl)methyl]-N-phenylacetamide
CID 10995887
2-(4-ethyl-N-propanoylanilino)acetic acid
CID 28766085
N-benzyl-N-(3,4-dihydroxyphenyl)propanamide
CID 67853659
N-[(4-fluorophenyl)methyl]-N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]propanamide
CID 46045670
N-[(3-methylphenyl)methyl]-N-[4-[2-oxo-2-(prop-2-enylamino)ethyl]phenyl]propanamide
CID 46046597
N-[4-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 46046855
2-chloro-N-[(3-chlorophenyl)methyl]-N-(4-methylphenyl)acetamide
CID 39443934
2-methyl-3-[(4-methylphenyl)methyl-propanoylamino]propanoic acid
CID 82323323

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide (CID 139238463) is N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide is CCC(=O)N(Cc1ccc(C)cc1)c1ccc(C)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is UXPYSJJVNAUXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-4-18(20)19(17-11-7-15(3)8-12-17)13-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3.
What are the key properties of N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide?
N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 267.37 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 139238463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).