2-(2-aminoquinazolin-4-yl)oxyethanol

C10H11N3O2 — CID 80859584

IUPAC2-(2-aminoquinazolin-4-yl)oxyethanol
SMILESNc1nc(OCCO)c2ccccc2n1
InChIInChI=1S/C10H11N3O2/c11-10-12-8-4-2-1-3-7(8)9(13-10)15-6-5-14/h1-4,14H,5-6H2,(H2,11,12,13)
InChIKeyQDELDZCTJCVSLB-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.58
Rot. Bonds3

About 2-(2-aminoquinazolin-4-yl)oxyethanol

2-(2-aminoquinazolin-4-yl)oxyethanol (PubChem CID 80859584) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 2-(2-aminoquinazolin-4-yl)oxyethanol.

Molecular Properties

Compound Name2-(2-aminoquinazolin-4-yl)oxyethanol
PubChem CID80859584
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name2-(2-aminoquinazolin-4-yl)oxyethanol
SMILESNc1nc(OCCO)c2ccccc2n1
InChIInChI=1S/C10H11N3O2/c11-10-12-8-4-2-1-3-7(8)9(13-10)15-6-5-14/h1-4,14H,5-6H2,(H2,11,12,13)
InChIKeyQDELDZCTJCVSLB-UHFFFAOYSA-N
XLogP0.58
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoquinazolin-4-yl)oxyethanol?
The IUPAC name of 2-(2-aminoquinazolin-4-yl)oxyethanol (CID 80859584) is 2-(2-aminoquinazolin-4-yl)oxyethanol.
What is the SMILES notation for 2-(2-aminoquinazolin-4-yl)oxyethanol?
The canonical SMILES for 2-(2-aminoquinazolin-4-yl)oxyethanol is Nc1nc(OCCO)c2ccccc2n1.
What is the InChIKey of 2-(2-aminoquinazolin-4-yl)oxyethanol?
The InChIKey is QDELDZCTJCVSLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c11-10-12-8-4-2-1-3-7(8)9(13-10)15-6-5-14/h1-4,14H,5-6H2,(H2,11,12,13).
What are the key properties of 2-(2-aminoquinazolin-4-yl)oxyethanol?
2-(2-aminoquinazolin-4-yl)oxyethanol has a molecular weight of 205.22 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoquinazolin-4-yl)oxyethanol is sourced from PubChem (CID 80859584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).