2-(1H-imidazol-5-yl)quinazoline

C11H8N4 — CID 91268038

IUPAC2-(1H-imidazol-5-yl)quinazoline
SMILESc1ccc2nc(-c3cnc[nH]3)ncc2c1
InChIInChI=1S/C11H8N4/c1-2-4-9-8(3-1)5-13-11(15-9)10-6-12-7-14-10/h1-7H,(H,12,14)
InChIKeyZWKMRKGIKJZPMC-UHFFFAOYSA-N
MW196.21 g/mol
LogP2.02
Rot. Bonds1

About 2-(1H-imidazol-5-yl)quinazoline

2-(1H-imidazol-5-yl)quinazoline (PubChem CID 91268038) has the molecular formula C11H8N4 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-(1H-imidazol-5-yl)quinazoline.

Molecular Properties

Compound Name2-(1H-imidazol-5-yl)quinazoline
PubChem CID91268038
Molecular FormulaC11H8N4
Molecular Weight196.21 g/mol
Exact Mass196.07
IUPAC Name2-(1H-imidazol-5-yl)quinazoline
SMILESc1ccc2nc(-c3cnc[nH]3)ncc2c1
InChIInChI=1S/C11H8N4/c1-2-4-9-8(3-1)5-13-11(15-9)10-6-12-7-14-10/h1-7H,(H,12,14)
InChIKeyZWKMRKGIKJZPMC-UHFFFAOYSA-N
XLogP2.02
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-5-yl)quinazoline?
The IUPAC name of 2-(1H-imidazol-5-yl)quinazoline (CID 91268038) is 2-(1H-imidazol-5-yl)quinazoline.
What is the SMILES notation for 2-(1H-imidazol-5-yl)quinazoline?
The canonical SMILES for 2-(1H-imidazol-5-yl)quinazoline is c1ccc2nc(-c3cnc[nH]3)ncc2c1.
What is the InChIKey of 2-(1H-imidazol-5-yl)quinazoline?
The InChIKey is ZWKMRKGIKJZPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4/c1-2-4-9-8(3-1)5-13-11(15-9)10-6-12-7-14-10/h1-7H,(H,12,14).
What are the key properties of 2-(1H-imidazol-5-yl)quinazoline?
2-(1H-imidazol-5-yl)quinazoline has a molecular weight of 196.21 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-5-yl)quinazoline is sourced from PubChem (CID 91268038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).