2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide

C18H17N3O2 — CID 110735682

IUPAC2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(-c2nc[nH]c2C)cc1
InChIInChI=1S/C18H17N3O2/c1-12-17(20-11-19-12)13-7-9-14(10-8-13)21-18(22)15-5-3-4-6-16(15)23-2/h3-11H,1-2H3,(H,19,20)(H,21,22)
InChIKeyNINCIYOWAONPSQ-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.65
Rot. Bonds4

About 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide

2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide (PubChem CID 110735682) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
PubChem CID110735682
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(-c2nc[nH]c2C)cc1
InChIInChI=1S/C18H17N3O2/c1-12-17(20-11-19-12)13-7-9-14(10-8-13)21-18(22)15-5-3-4-6-16(15)23-2/h3-11H,1-2H3,(H,19,20)(H,21,22)
InChIKeyNINCIYOWAONPSQ-UHFFFAOYSA-N
XLogP3.65
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2-methoxy-N-(4-quinolin-2-ylphenyl)benzamide
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N-[4-(4-ethoxyphenoxy)phenyl]-2-methoxybenzamide
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N-[4-(1,3-dioxoisoindol-2-yl)phenyl]-2-methoxybenzamide
CID 110352322

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The IUPAC name of 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide (CID 110735682) is 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The canonical SMILES for 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide is COc1ccccc1C(=O)Nc1ccc(-c2nc[nH]c2C)cc1.
What is the InChIKey of 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The InChIKey is NINCIYOWAONPSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-17(20-11-19-12)13-7-9-14(10-8-13)21-18(22)15-5-3-4-6-16(15)23-2/h3-11H,1-2H3,(H,19,20)(H,21,22).
What are the key properties of 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide has a molecular weight of 307.35 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 110735682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).