N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide

C18H21NO — CID 17326783

IUPACN-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide
SMILESCCc1ccc(C(C)NC(=O)c2ccccc2C)cc1
InChIInChI=1S/C18H21NO/c1-4-15-9-11-16(12-10-15)14(3)19-18(20)17-8-6-5-7-13(17)2/h5-12,14H,4H2,1-3H3,(H,19,20)
InChIKeyHKFRDATTZDPUQG-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.05
Rot. Bonds4

About N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide

N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide (PubChem CID 17326783) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide
PubChem CID17326783
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide
SMILESCCc1ccc(C(C)NC(=O)c2ccccc2C)cc1
InChIInChI=1S/C18H21NO/c1-4-15-9-11-16(12-10-15)14(3)19-18(20)17-8-6-5-7-13(17)2/h5-12,14H,4H2,1-3H3,(H,19,20)
InChIKeyHKFRDATTZDPUQG-UHFFFAOYSA-N
XLogP4.05
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 ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[(1S)-1-(4-methylphenyl)ethyl]benzamide
CID 30386627
2-methyl-N-[(1R)-1-phenylethyl]benzamide
CID 681346
N-[(1S)-1-(4-ethylphenyl)ethyl]-2,4,5-trimethylbenzamide
CID 100712064
2-methyl-N-[(1S)-1-(4-methylsulfanylphenyl)ethyl]benzamide
CID 34483278
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-2-methylbenzamide
CID 46422034
2-chloro-N-[1-(4-ethylphenyl)ethyl]pyridine-3-carboxamide
CID 17326874
N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[methyl(methylsulfonyl)amino]benzamide
CID 94612968
N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide
CID 51857347
2-(benzenesulfonamido)-N-[(1S)-1-(4-ethylphenyl)ethyl]benzamide
CID 100620253
2-[2-(dimethylamino)-2-oxoethoxy]-N-[1-(4-ethylphenyl)ethyl]benzamide
CID 46521998
N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 100756077
N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide (CID 17326783) is N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide is CCc1ccc(C(C)NC(=O)c2ccccc2C)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide?
The InChIKey is HKFRDATTZDPUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-4-15-9-11-16(12-10-15)14(3)19-18(20)17-8-6-5-7-13(17)2/h5-12,14H,4H2,1-3H3,(H,19,20).
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide?
N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide has a molecular weight of 267.37 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-2-methylbenzamide is sourced from PubChem (CID 17326783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).