N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide

C10H9N3O2 — CID 47266240

IUPACN-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide
SMILESO=C1CN=C(NC(=O)c2ccccc2)N1
InChIInChI=1S/C10H9N3O2/c14-8-6-11-10(12-8)13-9(15)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,12,13,14,15)
InChIKeyWIRXVPKCWWFETJ-UHFFFAOYSA-N
MW203.20 g/mol
LogP-0.10
Rot. Bonds1

About N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide

N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide (PubChem CID 47266240) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide.

Molecular Properties

Compound NameN-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide
PubChem CID47266240
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC NameN-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide
SMILESO=C1CN=C(NC(=O)c2ccccc2)N1
InChIInChI=1S/C10H9N3O2/c14-8-6-11-10(12-8)13-9(15)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,12,13,14,15)
InChIKeyWIRXVPKCWWFETJ-UHFFFAOYSA-N
XLogP-0.10
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide?
The IUPAC name of N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide (CID 47266240) is N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide.
What is the SMILES notation for N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide?
The canonical SMILES for N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide is O=C1CN=C(NC(=O)c2ccccc2)N1.
What is the InChIKey of N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide?
The InChIKey is WIRXVPKCWWFETJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c14-8-6-11-10(12-8)13-9(15)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,12,13,14,15).
What are the key properties of N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide?
N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide has a molecular weight of 203.20 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide is sourced from PubChem (CID 47266240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).