2-(3-ethylanilino)-N-(4-methylphenyl)propanamide

C18H22N2O — CID 60638712

IUPAC2-(3-ethylanilino)-N-(4-methylphenyl)propanamide
SMILESCCc1cccc(NC(C)C(=O)Nc2ccc(C)cc2)c1
InChIInChI=1S/C18H22N2O/c1-4-15-6-5-7-17(12-15)19-14(3)18(21)20-16-10-8-13(2)9-11-16/h5-12,14,19H,4H2,1-3H3,(H,20,21)
InChIKeyGOXHDXQQOBRXNV-UHFFFAOYSA-N
MW282.39 g/mol
LogP4.00
Rot. Bonds5

About 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide

2-(3-ethylanilino)-N-(4-methylphenyl)propanamide (PubChem CID 60638712) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(3-ethylanilino)-N-(4-methylphenyl)propanamide
PubChem CID60638712
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-(3-ethylanilino)-N-(4-methylphenyl)propanamide
SMILESCCc1cccc(NC(C)C(=O)Nc2ccc(C)cc2)c1
InChIInChI=1S/C18H22N2O/c1-4-15-6-5-7-17(12-15)19-14(3)18(21)20-16-10-8-13(2)9-11-16/h5-12,14,19H,4H2,1-3H3,(H,20,21)
InChIKeyGOXHDXQQOBRXNV-UHFFFAOYSA-N
XLogP4.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethylanilino)-N-(2-fluoro-4-methylphenyl)propanamide
CID 78841829
2-(3-ethylanilino)-N-(3-methylbutyl)propanamide
CID 43113209
2-(3-ethylanilino)-N-(methylcarbamoyl)propanamide
CID 43084470
N-(2,5-difluorophenyl)-2-(3-ethylanilino)propanamide
CID 46667072
(2R)-N-[4-(dimethylamino)phenyl]-2-[3-(hydroxymethyl)anilino]propanamide
CID 9299409
N-(3-fluorophenyl)-2-(4-methylanilino)propanamide
CID 51242421
2-(2,6-diethylanilino)-N-(4-ethylphenyl)propanamide
CID 13252290
2-(3-fluoro-4-methylanilino)-N-(4-methylphenyl)propanamide
CID 60638752
N-[4-(difluoromethoxy)phenyl]-2-[3-(hydroxymethyl)anilino]propanamide
CID 110878851
N-(3-fluorophenyl)-2-[3-(hydroxymethyl)anilino]propanamide
CID 110880177
N-(3-bromophenyl)-2-[3-(hydroxymethyl)anilino]propanamide
CID 110880174
N-(2,4-dimethylphenyl)-2-(4-ethylanilino)propanamide
CID 46757541

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide?
The IUPAC name of 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide (CID 60638712) is 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide.
What is the SMILES notation for 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide?
The canonical SMILES for 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide is CCc1cccc(NC(C)C(=O)Nc2ccc(C)cc2)c1.
What is the InChIKey of 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide?
The InChIKey is GOXHDXQQOBRXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-4-15-6-5-7-17(12-15)19-14(3)18(21)20-16-10-8-13(2)9-11-16/h5-12,14,19H,4H2,1-3H3,(H,20,21).
What are the key properties of 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide?
2-(3-ethylanilino)-N-(4-methylphenyl)propanamide has a molecular weight of 282.39 g/mol, XLogP of 4.00, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylanilino)-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 60638712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).