3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide

C19H23NO — CID 142077467

IUPAC3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide
SMILESCCc1cccc(C(=O)Nc2ccc(C(C)C)c(C)c2)c1
InChIInChI=1S/C19H23NO/c1-5-15-7-6-8-16(12-15)19(21)20-17-9-10-18(13(2)3)14(4)11-17/h6-13H,5H2,1-4H3,(H,20,21)
InChIKeyOUNUNLNCJWJDDJ-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.93
Rot. Bonds4

About 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide

3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide (PubChem CID 142077467) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide
PubChem CID142077467
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide
SMILESCCc1cccc(C(=O)Nc2ccc(C(C)C)c(C)c2)c1
InChIInChI=1S/C19H23NO/c1-5-15-7-6-8-16(12-15)19(21)20-17-9-10-18(13(2)3)14(4)11-17/h6-13H,5H2,1-4H3,(H,20,21)
InChIKeyOUNUNLNCJWJDDJ-UHFFFAOYSA-N
XLogP4.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-methyl-4-propan-2-ylphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide
CID 20597704
N-(4-ethyl-3-methylphenyl)-3-propylbenzamide
CID 142077280
1-N,3-N,5-N-tris(3-ethylphenyl)benzene-1,3,5-tricarboxamide
CID 67992311
N-(3-ethylphenyl)-3-iodobenzamide
CID 2591482
3-amino-N-(3-ethylphenyl)-4-methylbenzamide
CID 16793362
N-(3-methylphenyl)-3-(2-methylpropyl)benzamide
CID 158758785
N-(3-ethylphenyl)-3-methoxybenzamide
CID 896052
3-ethyl-N-methylbenzamide
CID 59115297
3-N-butan-2-yl-1-N-(4-ethylphenyl)benzene-1,3-dicarboxamide
CID 109051525
N-(3-ethylphenyl)-3-phenoxybenzamide
CID 7935232
3-amino-4-bromo-N-(3-ethylphenyl)benzamide
CID 61090789
3-(cyclopropanecarbonylamino)-N-(3-ethylphenyl)benzamide
CID 32736931

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide?
The IUPAC name of 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide (CID 142077467) is 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide?
The canonical SMILES for 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide is CCc1cccc(C(=O)Nc2ccc(C(C)C)c(C)c2)c1.
What is the InChIKey of 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide?
The InChIKey is OUNUNLNCJWJDDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-5-15-7-6-8-16(12-15)19(21)20-17-9-10-18(13(2)3)14(4)11-17/h6-13H,5H2,1-4H3,(H,20,21).
What are the key properties of 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide?
3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide has a molecular weight of 281.40 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(3-methyl-4-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 142077467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).