2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide

C15H18N4O2 — CID 115620125

IUPAC2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)NCCc2ncc[nH]2)cc1
InChIInChI=1S/C15H18N4O2/c1-11(20)19-13-4-2-12(3-5-13)10-15(21)18-7-6-14-16-8-9-17-14/h2-5,8-9H,6-7,10H2,1H3,(H,16,17)(H,18,21)(H,19,20)
InChIKeyLYQJYDBNUFPZHR-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.27
Rot. Bonds6

About 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide

2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide (PubChem CID 115620125) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
PubChem CID115620125
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)NCCc2ncc[nH]2)cc1
InChIInChI=1S/C15H18N4O2/c1-11(20)19-13-4-2-12(3-5-13)10-15(21)18-7-6-14-16-8-9-17-14/h2-5,8-9H,6-7,10H2,1H3,(H,16,17)(H,18,21)(H,19,20)
InChIKeyLYQJYDBNUFPZHR-UHFFFAOYSA-N
XLogP1.27
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dichlorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 115649653
2-(3-fluoro-4-methoxyphenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 115668455
N-[2-(1H-imidazol-2-yl)ethyl]-2-(3-methoxyphenyl)acetamide
CID 115620121
N-[2-(1H-imidazol-2-yl)ethyl]-3-methoxypropanamide
CID 115668473
6-acetamido-N-[2-(1H-imidazol-2-yl)ethyl]hexanamide
CID 115649646
2-(2-aminophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 113315085
2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 115686762
2-(4-acetamidophenyl)-N-(2-hydroxyethyl)acetamide
CID 11287807
N-[2-(1H-imidazol-2-yl)ethyl]-3-pyridin-4-ylpropanamide
CID 115668506
N-[2-[2-(1H-imidazol-2-yl)ethylamino]-2-oxoethyl]-4-methylbenzamide
CID 115670758
2-[4-(1H-imidazol-2-ylmethylcarbamoylamino)phenyl]acetic acid
CID 64524531
N-[2-[2-(1H-imidazol-2-yl)ethylamino]-2-oxoethyl]benzamide
CID 115620128

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide (CID 115620125) is 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide is CC(=O)Nc1ccc(CC(=O)NCCc2ncc[nH]2)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
The InChIKey is LYQJYDBNUFPZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-11(20)19-13-4-2-12(3-5-13)10-15(21)18-7-6-14-16-8-9-17-14/h2-5,8-9H,6-7,10H2,1H3,(H,16,17)(H,18,21)(H,19,20).
What are the key properties of 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide has a molecular weight of 286.34 g/mol, XLogP of 1.27, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 115620125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).