1-phenyl-2H-quinazoline

C14H12N2 — CID 15358120

IUPAC1-phenyl-2H-quinazoline
SMILESC1=NCN(c2ccccc2)c2ccccc21
InChIInChI=1S/C14H12N2/c1-2-7-13(8-3-1)16-11-15-10-12-6-4-5-9-14(12)16/h1-10H,11H2
InChIKeyIJPHDOYKNHLAQJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.21
Rot. Bonds1

About 1-phenyl-2H-quinazoline

1-phenyl-2H-quinazoline (PubChem CID 15358120) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-phenyl-2H-quinazoline.

Molecular Properties

Compound Name1-phenyl-2H-quinazoline
PubChem CID15358120
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name1-phenyl-2H-quinazoline
SMILESC1=NCN(c2ccccc2)c2ccccc21
InChIInChI=1S/C14H12N2/c1-2-7-13(8-3-1)16-11-15-10-12-6-4-5-9-14(12)16/h1-10H,11H2
InChIKeyIJPHDOYKNHLAQJ-UHFFFAOYSA-N
XLogP3.21
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2H-quinazoline?
The IUPAC name of 1-phenyl-2H-quinazoline (CID 15358120) is 1-phenyl-2H-quinazoline.
What is the SMILES notation for 1-phenyl-2H-quinazoline?
The canonical SMILES for 1-phenyl-2H-quinazoline is C1=NCN(c2ccccc2)c2ccccc21.
What is the InChIKey of 1-phenyl-2H-quinazoline?
The InChIKey is IJPHDOYKNHLAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c1-2-7-13(8-3-1)16-11-15-10-12-6-4-5-9-14(12)16/h1-10H,11H2.
What are the key properties of 1-phenyl-2H-quinazoline?
1-phenyl-2H-quinazoline has a molecular weight of 208.26 g/mol, XLogP of 3.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2H-quinazoline is sourced from PubChem (CID 15358120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).