N-(4-ethyl-3-methylphenyl)-3-propylbenzamide

C19H23NO — CID 142077280

IUPACN-(4-ethyl-3-methylphenyl)-3-propylbenzamide
SMILESCCCc1cccc(C(=O)Nc2ccc(CC)c(C)c2)c1
InChIInChI=1S/C19H23NO/c1-4-7-15-8-6-9-17(13-15)19(21)20-18-11-10-16(5-2)14(3)12-18/h6,8-13H,4-5,7H2,1-3H3,(H,20,21)
InChIKeySMARRBYFUVVBEC-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.76
Rot. Bonds5

About N-(4-ethyl-3-methylphenyl)-3-propylbenzamide

N-(4-ethyl-3-methylphenyl)-3-propylbenzamide (PubChem CID 142077280) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(4-ethyl-3-methylphenyl)-3-propylbenzamide.

Molecular Properties

Compound NameN-(4-ethyl-3-methylphenyl)-3-propylbenzamide
PubChem CID142077280
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-(4-ethyl-3-methylphenyl)-3-propylbenzamide
SMILESCCCc1cccc(C(=O)Nc2ccc(CC)c(C)c2)c1
InChIInChI=1S/C19H23NO/c1-4-7-15-8-6-9-17(13-15)19(21)20-18-11-10-16(5-2)14(3)12-18/h6,8-13H,4-5,7H2,1-3H3,(H,20,21)
InChIKeySMARRBYFUVVBEC-UHFFFAOYSA-N
XLogP4.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-fluorophenyl)-3-propylbenzamide
CID 67124945
3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide
CID 142077467
3-fluoro-N-(4-propylphenyl)benzamide
CID 26178121
3-methyl-4-propyl-N-[3-(trifluoromethyl)phenyl]benzamide
CID 165142528
3-(benzylcarbamoylamino)-N-(4-propylphenyl)benzamide
CID 20667039
3-(2-amino-2-sulfanylideneethyl)-N-(4-ethylphenyl)benzamide
CID 82179523
N-(3-hydroxy-5-propylphenyl)-3-methylbenzamide
CID 58482868
N-(4-bromo-3-methylphenyl)-3-(methylsulfonylmethyl)benzamide
CID 27667538
N-[2-(ethylamino)-2-oxoethyl]-3-propylbenzamide
CID 71109879
N-[(3-propylbenzoyl)amino]formamide
CID 143851334
3-bromo-4-methyl-N-(4-propylphenyl)benzamide
CID 81472098
N-(4-bromo-3,5-dimethylphenyl)-3-(chloromethyl)benzamide
CID 107573025

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-3-methylphenyl)-3-propylbenzamide?
The IUPAC name of N-(4-ethyl-3-methylphenyl)-3-propylbenzamide (CID 142077280) is N-(4-ethyl-3-methylphenyl)-3-propylbenzamide.
What is the SMILES notation for N-(4-ethyl-3-methylphenyl)-3-propylbenzamide?
The canonical SMILES for N-(4-ethyl-3-methylphenyl)-3-propylbenzamide is CCCc1cccc(C(=O)Nc2ccc(CC)c(C)c2)c1.
What is the InChIKey of N-(4-ethyl-3-methylphenyl)-3-propylbenzamide?
The InChIKey is SMARRBYFUVVBEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-4-7-15-8-6-9-17(13-15)19(21)20-18-11-10-16(5-2)14(3)12-18/h6,8-13H,4-5,7H2,1-3H3,(H,20,21).
What are the key properties of N-(4-ethyl-3-methylphenyl)-3-propylbenzamide?
N-(4-ethyl-3-methylphenyl)-3-propylbenzamide has a molecular weight of 281.40 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-3-methylphenyl)-3-propylbenzamide is sourced from PubChem (CID 142077280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).