2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide

C19H24N2O — CID 112839414

IUPAC2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide
SMILESCc1ccc(NC(=O)C(C)C)cc1NCCc1ccccc1
InChIInChI=1S/C19H24N2O/c1-14(2)19(22)21-17-10-9-15(3)18(13-17)20-12-11-16-7-5-4-6-8-16/h4-10,13-14,20H,11-12H2,1-3H3,(H,21,22)
InChIKeyXQDIUTNZWHJYMC-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.24
Rot. Bonds6

About 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide

2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide (PubChem CID 112839414) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide
PubChem CID112839414
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide
SMILESCc1ccc(NC(=O)C(C)C)cc1NCCc1ccccc1
InChIInChI=1S/C19H24N2O/c1-14(2)19(22)21-17-10-9-15(3)18(13-17)20-12-11-16-7-5-4-6-8-16/h4-10,13-14,20H,11-12H2,1-3H3,(H,21,22)
InChIKeyXQDIUTNZWHJYMC-UHFFFAOYSA-N
XLogP4.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[4-methyl-3-(3-phenylpropanoylamino)phenyl]propanamide
CID 46485889
N-[2-methyl-5-(2-phenylethylamino)phenyl]acetamide
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2-methyl-N-[4-methyl-3-(naphthalen-2-ylmethylamino)phenyl]propanamide
CID 112839413
N-[3-[[2-(2-fluoroanilino)-2-oxoethyl]amino]-4-methylphenyl]-2-methylpropanamide
CID 87029073
2-methyl-N-[4-methyl-3-[[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]phenyl]propanamide
CID 60537469
N-[3-[3-(2-methoxyphenyl)propanoylamino]-4-methylphenyl]-2-methylpropanamide
CID 55708058
N-[3-(3-aminopropanoylamino)-4-methylphenyl]-2-methylpropanamide
CID 82034485
2-methyl-N-[4-methyl-3-[[2-oxo-2-(pentan-3-ylamino)ethyl]amino]phenyl]propanamide
CID 47063867
N-[3-[(3-amino-3-phenylpropanoyl)amino]-4-methylphenyl]-2-methylpropanamide
CID 119949941
3-methyl-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-2-phenylpentanamide
CID 55765150
2-methyl-N-[4-[[(2S)-4-phenylbutan-2-yl]carbamoylamino]phenyl]propanamide
CID 51945465
2-methyl-N-[4-[[(2R)-4-phenylbutan-2-yl]carbamoylamino]phenyl]propanamide
CID 51945466

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide (CID 112839414) is 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide is Cc1ccc(NC(=O)C(C)C)cc1NCCc1ccccc1.
What is the InChIKey of 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide?
The InChIKey is XQDIUTNZWHJYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-14(2)19(22)21-17-10-9-15(3)18(13-17)20-12-11-16-7-5-4-6-8-16/h4-10,13-14,20H,11-12H2,1-3H3,(H,21,22).
What are the key properties of 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide?
2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.24, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-methyl-3-(2-phenylethylamino)phenyl]propanamide is sourced from PubChem (CID 112839414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).