(2-aminobenzimidazol-1-yl)-phenylmethanone

C14H11N3O — CID 1088430

IUPAC(2-aminobenzimidazol-1-yl)-phenylmethanone
SMILESNc1nc2ccccc2n1C(=O)c1ccccc1
InChIInChI=1S/C14H11N3O/c15-14-16-11-8-4-5-9-12(11)17(14)13(18)10-6-2-1-3-7-10/h1-9H,(H2,15,16)
InChIKeyRQUFEIGQKKAODE-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.31
Rot. Bonds1

About (2-aminobenzimidazol-1-yl)-phenylmethanone

(2-aminobenzimidazol-1-yl)-phenylmethanone (PubChem CID 1088430) has the molecular formula C14H11N3O and a molecular weight of 237.26 g/mol. Its IUPAC name is (2-aminobenzimidazol-1-yl)-phenylmethanone.

Molecular Properties

Compound Name(2-aminobenzimidazol-1-yl)-phenylmethanone
PubChem CID1088430
Molecular FormulaC14H11N3O
Molecular Weight237.26 g/mol
Exact Mass237.09
IUPAC Name(2-aminobenzimidazol-1-yl)-phenylmethanone
SMILESNc1nc2ccccc2n1C(=O)c1ccccc1
InChIInChI=1S/C14H11N3O/c15-14-16-11-8-4-5-9-12(11)17(14)13(18)10-6-2-1-3-7-10/h1-9H,(H2,15,16)
InChIKeyRQUFEIGQKKAODE-UHFFFAOYSA-N
XLogP2.31
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (2-aminobenzimidazol-1-yl)-phenylmethanone?
The IUPAC name of (2-aminobenzimidazol-1-yl)-phenylmethanone (CID 1088430) is (2-aminobenzimidazol-1-yl)-phenylmethanone.
What is the SMILES notation for (2-aminobenzimidazol-1-yl)-phenylmethanone?
The canonical SMILES for (2-aminobenzimidazol-1-yl)-phenylmethanone is Nc1nc2ccccc2n1C(=O)c1ccccc1.
What is the InChIKey of (2-aminobenzimidazol-1-yl)-phenylmethanone?
The InChIKey is RQUFEIGQKKAODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O/c15-14-16-11-8-4-5-9-12(11)17(14)13(18)10-6-2-1-3-7-10/h1-9H,(H2,15,16).
What are the key properties of (2-aminobenzimidazol-1-yl)-phenylmethanone?
(2-aminobenzimidazol-1-yl)-phenylmethanone has a molecular weight of 237.26 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminobenzimidazol-1-yl)-phenylmethanone is sourced from PubChem (CID 1088430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).