3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide

C19H24N2O — CID 112766095

IUPAC3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide
SMILESCCC(NC(=O)c1cccc(N(C)C)c1)c1ccc(C)cc1
InChIInChI=1S/C19H24N2O/c1-5-18(15-11-9-14(2)10-12-15)20-19(22)16-7-6-8-17(13-16)21(3)4/h6-13,18H,5H2,1-4H3,(H,20,22)
InChIKeyQNCHZLKBMGMUPM-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.94
Rot. Bonds5

About 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide

3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide (PubChem CID 112766095) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide
PubChem CID112766095
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide
SMILESCCC(NC(=O)c1cccc(N(C)C)c1)c1ccc(C)cc1
InChIInChI=1S/C19H24N2O/c1-5-18(15-11-9-14(2)10-12-15)20-19(22)16-7-6-8-17(13-16)21(3)4/h6-13,18H,5H2,1-4H3,(H,20,22)
InChIKeyQNCHZLKBMGMUPM-UHFFFAOYSA-N
XLogP3.94
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide
CID 24543534
N-[cyano-(4-methylphenyl)methyl]-3-(dimethylamino)benzamide
CID 110664187
N-[(2R)-butan-2-yl]-3-(dimethylamino)benzamide
CID 25345776
N-butan-2-yl-3-(dimethylamino)benzamide
CID 17310829
3-(dimethylamino)-N-[(2S)-2-hydroxy-2-(4-methylphenyl)ethyl]benzamide
CID 51941960
3-[(4-fluorophenyl)-methylsulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide
CID 132672050
N-[(1S)-1-(4-methylphenyl)propyl]-2H-benzotriazole-5-carboxamide
CID 51562771
N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 17328245
3-(dimethylamino)-N-(4-methylphenyl)benzamide
CID 7899886
4-chloro-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 841144
N-[1-(4-bromophenyl)propyl]-4-(dimethylamino)benzamide
CID 43011620
N-[(1R)-1-(4-methylphenyl)propyl]-3-(morpholin-4-ylmethyl)benzamide
CID 94013067

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide (CID 112766095) is 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide is CCC(NC(=O)c1cccc(N(C)C)c1)c1ccc(C)cc1.
What is the InChIKey of 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide?
The InChIKey is QNCHZLKBMGMUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-5-18(15-11-9-14(2)10-12-15)20-19(22)16-7-6-8-17(13-16)21(3)4/h6-13,18H,5H2,1-4H3,(H,20,22).
What are the key properties of 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide?
3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide has a molecular weight of 296.41 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide is sourced from PubChem (CID 112766095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).