(4-phenylmethoxyquinazolin-6-yl)methanol

C16H14N2O2 — CID 71255389

IUPAC(4-phenylmethoxyquinazolin-6-yl)methanol
SMILESOCc1ccc2ncnc(OCc3ccccc3)c2c1
InChIInChI=1S/C16H14N2O2/c19-9-13-6-7-15-14(8-13)16(18-11-17-15)20-10-12-4-2-1-3-5-12/h1-8,11,19H,9-10H2
InChIKeyXTTWGRIBDUDIFD-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.70
Rot. Bonds4

About (4-phenylmethoxyquinazolin-6-yl)methanol

(4-phenylmethoxyquinazolin-6-yl)methanol (PubChem CID 71255389) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is (4-phenylmethoxyquinazolin-6-yl)methanol.

Molecular Properties

Compound Name(4-phenylmethoxyquinazolin-6-yl)methanol
PubChem CID71255389
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name(4-phenylmethoxyquinazolin-6-yl)methanol
SMILESOCc1ccc2ncnc(OCc3ccccc3)c2c1
InChIInChI=1S/C16H14N2O2/c19-9-13-6-7-15-14(8-13)16(18-11-17-15)20-10-12-4-2-1-3-5-12/h1-8,11,19H,9-10H2
InChIKeyXTTWGRIBDUDIFD-UHFFFAOYSA-N
XLogP2.70
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-phenylmethoxyquinazolin-6-yl)methanol?
The IUPAC name of (4-phenylmethoxyquinazolin-6-yl)methanol (CID 71255389) is (4-phenylmethoxyquinazolin-6-yl)methanol.
What is the SMILES notation for (4-phenylmethoxyquinazolin-6-yl)methanol?
The canonical SMILES for (4-phenylmethoxyquinazolin-6-yl)methanol is OCc1ccc2ncnc(OCc3ccccc3)c2c1.
What is the InChIKey of (4-phenylmethoxyquinazolin-6-yl)methanol?
The InChIKey is XTTWGRIBDUDIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-9-13-6-7-15-14(8-13)16(18-11-17-15)20-10-12-4-2-1-3-5-12/h1-8,11,19H,9-10H2.
What are the key properties of (4-phenylmethoxyquinazolin-6-yl)methanol?
(4-phenylmethoxyquinazolin-6-yl)methanol has a molecular weight of 266.30 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenylmethoxyquinazolin-6-yl)methanol is sourced from PubChem (CID 71255389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).