N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide

C13H15N3O2 — CID 55028374

IUPACN-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2ccnc2C)cc1
InChIInChI=1S/C13H15N3O2/c1-10-14-7-8-16(10)9-13(17)15-11-3-5-12(18-2)6-4-11/h3-8H,9H2,1-2H3,(H,15,17)
InChIKeyPAQRKOYCWFQIKQ-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.84
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide

N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide (PubChem CID 55028374) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
PubChem CID55028374
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2ccnc2C)cc1
InChIInChI=1S/C13H15N3O2/c1-10-14-7-8-16(10)9-13(17)15-11-3-5-12(18-2)6-4-11/h3-8H,9H2,1-2H3,(H,15,17)
InChIKeyPAQRKOYCWFQIKQ-UHFFFAOYSA-N
XLogP1.84
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(2-methylimidazol-1-yl)acetyl]amino]benzamide
CID 42942992
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CID 43055653
N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide
CID 134704405
N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679434
N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide
CID 131931945
N-(4-methoxyphenyl)-2-(2-oxo-3-propan-2-ylimidazol-1-yl)acetamide
CID 116624934
N-(3-chlorophenyl)-2-(2-methylimidazol-1-yl)acetamide
CID 60724518
1-(4-methoxyphenyl)-2-[2-(2-methylimidazol-1-yl)ethyl]guanidine
CID 119120889
N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-2-(2-methylimidazol-1-yl)acetamide
CID 37225028
2-(3-amino-1,2,4-triazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 60911192
2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 122142305
2-(3-amino-2-oxo-1-pyridinyl)-N-(4-methoxyphenyl)acetamide
CID 62102933

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide (CID 55028374) is N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide is COc1ccc(NC(=O)Cn2ccnc2C)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide?
The InChIKey is PAQRKOYCWFQIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-10-14-7-8-16(10)9-13(17)15-11-3-5-12(18-2)6-4-11/h3-8H,9H2,1-2H3,(H,15,17).
What are the key properties of N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide?
N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide has a molecular weight of 245.28 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide is sourced from PubChem (CID 55028374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).