N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide

C20H25NO — CID 5183452

IUPACN-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCc1cccc(NC(=O)C(C)c2ccc(CC(C)C)cc2)c1
InChIInChI=1S/C20H25NO/c1-14(2)12-17-8-10-18(11-9-17)16(4)20(22)21-19-7-5-6-15(3)13-19/h5-11,13-14,16H,12H2,1-4H3,(H,21,22)
InChIKeyVSOVOTWMLCMLND-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.94
Rot. Bonds5

About N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide

N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide (PubChem CID 5183452) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
PubChem CID5183452
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC NameN-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCc1cccc(NC(=O)C(C)c2ccc(CC(C)C)cc2)c1
InChIInChI=1S/C20H25NO/c1-14(2)12-17-8-10-18(11-9-17)16(4)20(22)21-19-7-5-6-15(3)13-19/h5-11,13-14,16H,12H2,1-4H3,(H,21,22)
InChIKeyVSOVOTWMLCMLND-UHFFFAOYSA-N
XLogP4.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-N-(3,5-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228329
(2R)-N-(3-hydroxyphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 675116
2-[4-(2-methylpropyl)phenyl]-N-[3-(propanoylamino)phenyl]propanamide
CID 54782349
N,2-bis[4-(2-methylpropyl)phenyl]propanamide
CID 3436173
(2S)-N-(3,4-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228270
N-(3-methylphenyl)-3-[2-[4-(2-methylpropyl)phenyl]propanoylcarbamothioylamino]benzamide
CID 54782752
N-[3-(2-methylpropoxy)phenyl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 54781971
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(4-propan-2-ylphenyl)propanamide
CID 7313989
2-[4-(2-methylpropyl)phenyl]-N-[4-[4-[2-[4-(2-methylpropyl)phenyl]propanoylamino]phenyl]phenyl]propanamide
CID 54781151
N-(2,5-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 4681901
(2R)-N-(2,4-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228302
N-benzyl-3-[2-[4-(2-methylpropyl)phenyl]propanoylamino]benzamide
CID 54782283

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide?
The IUPAC name of N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide (CID 5183452) is N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide.
What is the SMILES notation for N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide?
The canonical SMILES for N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide is Cc1cccc(NC(=O)C(C)c2ccc(CC(C)C)cc2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide?
The InChIKey is VSOVOTWMLCMLND-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-14(2)12-17-8-10-18(11-9-17)16(4)20(22)21-19-7-5-6-15(3)13-19/h5-11,13-14,16H,12H2,1-4H3,(H,21,22).
What are the key properties of N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide?
N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide has a molecular weight of 295.43 g/mol, XLogP of 4.94, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide is sourced from PubChem (CID 5183452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).