N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide

C15H19N3O — CID 110684157

IUPACN-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)Cc1cnc[nH]1
InChIInChI=1S/C15H19N3O/c1-15(2,3)12-6-4-5-7-13(12)18-14(19)8-11-9-16-10-17-11/h4-7,9-10H,8H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyRJVBRBVUUWJNOH-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.89
Rot. Bonds3

About N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide

N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide (PubChem CID 110684157) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide
PubChem CID110684157
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)Cc1cnc[nH]1
InChIInChI=1S/C15H19N3O/c1-15(2,3)12-6-4-5-7-13(12)18-14(19)8-11-9-16-10-17-11/h4-7,9-10H,8H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyRJVBRBVUUWJNOH-UHFFFAOYSA-N
XLogP2.89
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-imidazol-5-yl)-N-(2-methylphenyl)acetamide
CID 110684137
2-(1H-imidazol-5-yl)-N-(2-propan-2-ylphenyl)acetamide
CID 110684152
N-(2-cyanophenyl)-2-(1H-imidazol-5-yl)acetamide
CID 110684247
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(1H-imidazol-5-yl)acetamide
CID 110684225
N-tert-butyl-2-(1H-imidazol-5-yl)acetamide
CID 25128925
N-(2,6-diethylphenyl)-2-(1H-imidazol-5-yl)acetamide
CID 110684155
N-(2-tert-butylphenyl)-2-methylsulfanylacetamide
CID 67575618
N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide
CID 7920165
N-(2-tert-butylphenyl)-2-(4-methoxyphenyl)acetamide
CID 890877
N-(2-tert-butylphenyl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide
CID 110858418
N-(2-tert-butylphenyl)-2-(1,3-thiazol-4-yl)acetamide
CID 110462978
N-(2-tert-butylphenyl)-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 136890125

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide?
The IUPAC name of N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide (CID 110684157) is N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide.
What is the SMILES notation for N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide?
The canonical SMILES for N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide is CC(C)(C)c1ccccc1NC(=O)Cc1cnc[nH]1.
What is the InChIKey of N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide?
The InChIKey is RJVBRBVUUWJNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-15(2,3)12-6-4-5-7-13(12)18-14(19)8-11-9-16-10-17-11/h4-7,9-10H,8H2,1-3H3,(H,16,17)(H,18,19).
What are the key properties of N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide?
N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide has a molecular weight of 257.34 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-2-(1H-imidazol-5-yl)acetamide is sourced from PubChem (CID 110684157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).