2,4-dimethyl-N-(4-propylphenyl)benzamide

C18H21NO — CID 42237293

IUPAC2,4-dimethyl-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2ccc(C)cc2C)cc1
InChIInChI=1S/C18H21NO/c1-4-5-15-7-9-16(10-8-15)19-18(20)17-11-6-13(2)12-14(17)3/h6-12H,4-5H2,1-3H3,(H,19,20)
InChIKeyYXMHBLYAKBAIGP-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.51
Rot. Bonds4

About 2,4-dimethyl-N-(4-propylphenyl)benzamide

2,4-dimethyl-N-(4-propylphenyl)benzamide (PubChem CID 42237293) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2,4-dimethyl-N-(4-propylphenyl)benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(4-propylphenyl)benzamide
PubChem CID42237293
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2,4-dimethyl-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2ccc(C)cc2C)cc1
InChIInChI=1S/C18H21NO/c1-4-5-15-7-9-16(10-8-15)19-18(20)17-11-6-13(2)12-14(17)3/h6-12H,4-5H2,1-3H3,(H,19,20)
InChIKeyYXMHBLYAKBAIGP-UHFFFAOYSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(2-aminoethyl)phenyl]-2,4-dimethylbenzamide
CID 62302184
N-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-2,4-dimethylbenzamide
CID 55664564
N-(4-butan-2-ylphenyl)-2,4-dimethylbenzamide
CID 4028729
N-(4-tert-butylphenyl)-2,4-dimethylbenzamide
CID 953234
4-hydroxy-N-[4-(2-hydroxyethyl)phenyl]-2-methylbenzamide
CID 103865733
N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide
CID 925377
2,4-dimethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 38352261
N-[4-(ethylaminomethyl)phenyl]-2,5-dimethylbenzamide
CID 106910156
3-bromo-4-methyl-N-(4-propylphenyl)benzamide
CID 81472098
2-fluoro-N-(4-propylphenyl)benzamide
CID 8803034
2,5-dimethyl-N-(4-methylphenyl)-4-[2-(4-methylphenyl)acetyl]benzamide
CID 158719301
2-chloro-4,5-difluoro-N-(4-propylphenyl)benzamide
CID 26178128

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(4-propylphenyl)benzamide?
The IUPAC name of 2,4-dimethyl-N-(4-propylphenyl)benzamide (CID 42237293) is 2,4-dimethyl-N-(4-propylphenyl)benzamide.
What is the SMILES notation for 2,4-dimethyl-N-(4-propylphenyl)benzamide?
The canonical SMILES for 2,4-dimethyl-N-(4-propylphenyl)benzamide is CCCc1ccc(NC(=O)c2ccc(C)cc2C)cc1.
What is the InChIKey of 2,4-dimethyl-N-(4-propylphenyl)benzamide?
The InChIKey is YXMHBLYAKBAIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-4-5-15-7-9-16(10-8-15)19-18(20)17-11-6-13(2)12-14(17)3/h6-12H,4-5H2,1-3H3,(H,19,20).
What are the key properties of 2,4-dimethyl-N-(4-propylphenyl)benzamide?
2,4-dimethyl-N-(4-propylphenyl)benzamide has a molecular weight of 267.37 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(4-propylphenyl)benzamide is sourced from PubChem (CID 42237293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).