2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide

C15H19N3O — CID 134220505

IUPAC2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide
SMILESCC(C)Cc1ccc(NC(=O)Cn2ccnc2)cc1
InChIInChI=1S/C15H19N3O/c1-12(2)9-13-3-5-14(6-4-13)17-15(19)10-18-8-7-16-11-18/h3-8,11-12H,9-10H2,1-2H3,(H,17,19)
InChIKeyPQZNJTYACMPBJD-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.72
Rot. Bonds5

About 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide

2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide (PubChem CID 134220505) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide.

Molecular Properties

Compound Name2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide
PubChem CID134220505
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide
SMILESCC(C)Cc1ccc(NC(=O)Cn2ccnc2)cc1
InChIInChI=1S/C15H19N3O/c1-12(2)9-13-3-5-14(6-4-13)17-15(19)10-18-8-7-16-11-18/h3-8,11-12H,9-10H2,1-2H3,(H,17,19)
InChIKeyPQZNJTYACMPBJD-UHFFFAOYSA-N
XLogP2.72
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(2-methylpropyl)anilino]-3-oxopropanoic acid
CID 115163213
2-(4-acetamidophenyl)-N-[(2S)-1-imidazol-1-ylpropan-2-yl]acetamide
CID 94024335
[4-(2-methylpropyl)phenyl]carbamic acid
CID 115170610
2-methyl-4-[4-(2-methylpropyl)anilino]-4-oxobutanoic acid
CID 115164929
N-[4-(2-methylpropyl)phenyl]carbamoyl chloride
CID 115194334
[4-(2-methylpropyl)phenyl]carbamothioic S-acid
CID 115169658
4-(imidazol-1-ylmethyl)-N-[4-[2-oxo-2-(propan-2-ylamino)ethyl]phenyl]benzamide
CID 55719023
2-imidazol-1-yl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 17410061
N-(4-hydroxyphenyl)-3-imidazol-1-ylpropanamide
CID 28739593
methyl 2-[4-(2-methylpropyl)anilino]-2-oxoacetate
CID 115142143
2-imidazol-1-yl-N-[5-[(E)-2-[5-(2-methylpropyl)-1,3-oxazol-2-yl]ethenyl]-1,3-thiazol-2-yl]acetamide
CID 87884819
2-imidazol-1-yl-N-[4-[[4-oxo-3-propan-2-yl-1-(2,4,6-trichlorophenyl)-5H-pyrazolo[5,4-d]pyrimidin-6-yl]methyl]phenyl]acetamide
CID 135528525

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide?
The IUPAC name of 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide (CID 134220505) is 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide.
What is the SMILES notation for 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide?
The canonical SMILES for 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide is CC(C)Cc1ccc(NC(=O)Cn2ccnc2)cc1.
What is the InChIKey of 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide?
The InChIKey is PQZNJTYACMPBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-12(2)9-13-3-5-14(6-4-13)17-15(19)10-18-8-7-16-11-18/h3-8,11-12H,9-10H2,1-2H3,(H,17,19).
What are the key properties of 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide?
2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide has a molecular weight of 257.34 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-[4-(2-methylpropyl)phenyl]acetamide is sourced from PubChem (CID 134220505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).