2-[(4-phenylquinazolin-2-yl)amino]ethanol

C16H15N3O — CID 661382

IUPAC2-[(4-phenylquinazolin-2-yl)amino]ethanol
SMILESOCCNc1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/C16H15N3O/c20-11-10-17-16-18-14-9-5-4-8-13(14)15(19-16)12-6-2-1-3-7-12/h1-9,20H,10-11H2,(H,17,18,19)
InChIKeySUBHOYOCFDCGBH-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.70
Rot. Bonds4

About 2-[(4-phenylquinazolin-2-yl)amino]ethanol

2-[(4-phenylquinazolin-2-yl)amino]ethanol (PubChem CID 661382) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-[(4-phenylquinazolin-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(4-phenylquinazolin-2-yl)amino]ethanol
PubChem CID661382
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-[(4-phenylquinazolin-2-yl)amino]ethanol
SMILESOCCNc1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/C16H15N3O/c20-11-10-17-16-18-14-9-5-4-8-13(14)15(19-16)12-6-2-1-3-7-12/h1-9,20H,10-11H2,(H,17,18,19)
InChIKeySUBHOYOCFDCGBH-UHFFFAOYSA-N
XLogP2.70
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-phenylquinazolin-2-yl)amino]ethanol?
The IUPAC name of 2-[(4-phenylquinazolin-2-yl)amino]ethanol (CID 661382) is 2-[(4-phenylquinazolin-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(4-phenylquinazolin-2-yl)amino]ethanol?
The canonical SMILES for 2-[(4-phenylquinazolin-2-yl)amino]ethanol is OCCNc1nc(-c2ccccc2)c2ccccc2n1.
What is the InChIKey of 2-[(4-phenylquinazolin-2-yl)amino]ethanol?
The InChIKey is SUBHOYOCFDCGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c20-11-10-17-16-18-14-9-5-4-8-13(14)15(19-16)12-6-2-1-3-7-12/h1-9,20H,10-11H2,(H,17,18,19).
What are the key properties of 2-[(4-phenylquinazolin-2-yl)amino]ethanol?
2-[(4-phenylquinazolin-2-yl)amino]ethanol has a molecular weight of 265.32 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenylquinazolin-2-yl)amino]ethanol is sourced from PubChem (CID 661382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).