N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide

C19H23N3O2 — CID 109036380

IUPACN-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide
SMILESCCc1ccc(NCCC(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-3-15-4-6-16(7-5-15)20-13-12-19(24)22-18-10-8-17(9-11-18)21-14(2)23/h4-11,20H,3,12-13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyBFGKHVOLECGAGC-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.65
Rot. Bonds7

About N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide

N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide (PubChem CID 109036380) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide
PubChem CID109036380
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide
SMILESCCc1ccc(NCCC(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-3-15-4-6-16(7-5-15)20-13-12-19(24)22-18-10-8-17(9-11-18)21-14(2)23/h4-11,20H,3,12-13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyBFGKHVOLECGAGC-UHFFFAOYSA-N
XLogP3.65
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethylphenyl)-3-(4-methylanilino)propanamide
CID 109034443
methyl 4-[[3-(4-ethylanilino)-3-oxopropyl]amino]benzoate
CID 109036302
3-(4-ethylanilino)-N-(4-propan-2-yloxyphenyl)propanamide
CID 109036370
N-(4-ethylphenyl)-3-(2,3,4-trifluoroanilino)propanamide
CID 109036338
3-(4-ethylanilino)-N-(3-methylphenyl)propanamide
CID 109034139
N-(4-acetamidophenyl)-3-(4-methoxyanilino)propanamide
CID 109039685
3-(4-acetamidoanilino)-N-(3-fluorophenyl)propanamide
CID 109041254
3-(4-acetamidoanilino)-N-(4-cyanophenyl)propanamide
CID 109041283
N-(4-acetamidophenyl)-3-(3,4-difluoroanilino)propanamide
CID 109041238
3-(butan-2-ylamino)-N-(4-ethylphenyl)propanamide
CID 109013160
N-(4-acetamidophenyl)-3-(2,4-difluoroanilino)propanamide
CID 109041216
N-(4-acetamidophenyl)-3-(propylamino)propanamide
CID 109011595

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide?
The IUPAC name of N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide (CID 109036380) is N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide.
What is the SMILES notation for N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide?
The canonical SMILES for N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide is CCc1ccc(NCCC(=O)Nc2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide?
The InChIKey is BFGKHVOLECGAGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-3-15-4-6-16(7-5-15)20-13-12-19(24)22-18-10-8-17(9-11-18)21-14(2)23/h4-11,20H,3,12-13H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide?
N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide has a molecular weight of 325.41 g/mol, XLogP of 3.65, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-(4-ethylanilino)propanamide is sourced from PubChem (CID 109036380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).