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

C18H21NO — CID 51857347

IUPACN-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide
SMILESCCc1ccc([C@@H](C)NC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO/c1-4-15-7-11-16(12-8-15)14(3)19-18(20)17-9-5-13(2)6-10-17/h5-12,14H,4H2,1-3H3,(H,19,20)/t14-/m1/s1
InChIKeyALNIBEHZLQAMRJ-CQSZACIVSA-N
MW267.37 g/mol
LogP4.05
Rot. Bonds4

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

N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide (PubChem CID 51857347) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide
PubChem CID51857347
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide
SMILESCCc1ccc([C@@H](C)NC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO/c1-4-15-7-11-16(12-8-15)14(3)19-18(20)17-9-5-13(2)6-10-17/h5-12,14H,4H2,1-3H3,(H,19,20)/t14-/m1/s1
InChIKeyALNIBEHZLQAMRJ-CQSZACIVSA-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

N-[(1R)-1-(4-ethylphenyl)ethyl]-4-iodobenzamide
CID 95356330
4-(aminomethyl)-N-[1-(4-ethylphenyl)ethyl]benzamide;hydrochloride
CID 119269307
N-[1-(4-ethylphenyl)ethyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 133166361
N-[1-(4-ethylphenyl)ethyl]pyridine-4-carboxamide
CID 6466147
4-(difluoromethylsulfonylmethyl)-N-[(1S)-1-(4-ethylphenyl)ethyl]benzamide
CID 96534711
[2-[[(1S)-1-(4-methylphenyl)ethyl]amino]-2-oxoethyl] 4-ethylbenzoate
CID 95181161
N-[1-(4-ethylphenyl)ethyl]-4-fluoro-3-methylbenzamide
CID 63483320
4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 730323
N-[(1R)-1-(4-ethoxyphenyl)ethyl]-4-[(4-methylphenyl)sulfanylmethyl]benzamide
CID 28570140
N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-[(4-methylphenyl)sulfanylmethyl]benzamide
CID 28570144
N-[(1S)-1-(4-ethylphenyl)ethyl]-2,4,5-trimethylbenzamide
CID 100712064
N-[1-(4-ethylphenyl)ethyl]furan-3-carboxamide
CID 51265005

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide?
The IUPAC name of N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide (CID 51857347) is N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide.
What is the SMILES notation for N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide?
The canonical SMILES for N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide is CCc1ccc([C@@H](C)NC(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide?
The InChIKey is ALNIBEHZLQAMRJ-CQSZACIVSA-N. The full InChI is InChI=1S/C18H21NO/c1-4-15-7-11-16(12-8-15)14(3)19-18(20)17-9-5-13(2)6-10-17/h5-12,14H,4H2,1-3H3,(H,19,20)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide?
N-[(1R)-1-(4-ethylphenyl)ethyl]-4-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-[(1R)-1-(4-ethylphenyl)ethyl]-4-methylbenzamide is sourced from PubChem (CID 51857347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).