2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide

C20H25NO — CID 100710053

IUPAC2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
SMILESCC[C@@H](NC(=O)c1cc(C)c(C)cc1C)c1ccc(C)cc1
InChIInChI=1S/C20H25NO/c1-6-19(17-9-7-13(2)8-10-17)21-20(22)18-12-15(4)14(3)11-16(18)5/h7-12,19H,6H2,1-5H3,(H,21,22)/t19-/m1/s1
InChIKeyQZGNZTWMWZDHKR-LJQANCHMSA-N
MW295.43 g/mol
LogP4.80
Rot. Bonds4

About 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide

2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide (PubChem CID 100710053) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
PubChem CID100710053
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
SMILESCC[C@@H](NC(=O)c1cc(C)c(C)cc1C)c1ccc(C)cc1
InChIInChI=1S/C20H25NO/c1-6-19(17-9-7-13(2)8-10-17)21-20(22)18-12-15(4)14(3)11-16(18)5/h7-12,19H,6H2,1-5H3,(H,21,22)/t19-/m1/s1
InChIKeyQZGNZTWMWZDHKR-LJQANCHMSA-N
XLogP4.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-(3,4-dimethoxyphenyl)propyl]-2,4,5-trimethylbenzamide
CID 100711328
4-chloro-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 841144
4,5-dimethoxy-2-methyl-N-(1-phenylpropyl)benzamide
CID 56728755
2-methyl-N-[(1S)-1-(4-methylphenyl)propyl]propanamide
CID 95358385
N-[(1R)-1-(4-methylphenyl)propyl]-2-methylsulfanylbenzamide
CID 28575186
N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 17328245
methyl 4-[[(1S)-1-(4-methylphenyl)propyl]carbamoyl]benzoate
CID 9297354
4-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide
CID 24543534
2,4,5-trimethyl-N-[(1S)-3-methyl-1-phenylbutyl]benzamide
CID 100710084
2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide
CID 94011780
2-(3,4-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 132760177
5-(cyclopropylsulfamoyl)-2-methyl-N-[1-(4-methylphenyl)propyl]benzamide
CID 55489119

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide?
The IUPAC name of 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide (CID 100710053) is 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide.
What is the SMILES notation for 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide?
The canonical SMILES for 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide is CC[C@@H](NC(=O)c1cc(C)c(C)cc1C)c1ccc(C)cc1.
What is the InChIKey of 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide?
The InChIKey is QZGNZTWMWZDHKR-LJQANCHMSA-N. The full InChI is InChI=1S/C20H25NO/c1-6-19(17-9-7-13(2)8-10-17)21-20(22)18-12-15(4)14(3)11-16(18)5/h7-12,19H,6H2,1-5H3,(H,21,22)/t19-/m1/s1.
What are the key properties of 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide?
2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide has a molecular weight of 295.43 g/mol, XLogP of 4.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide is sourced from PubChem (CID 100710053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).