4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol

C10H9ClN2O2 — CID 105482516

IUPAC4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol
SMILESOCCc1nc(Cl)c2cc(O)ccc2n1
InChIInChI=1S/C10H9ClN2O2/c11-10-7-5-6(15)1-2-8(7)12-9(13-10)3-4-14/h1-2,5,14-15H,3-4H2
InChIKeyBHCHFFMNMXQAQB-UHFFFAOYSA-N
MW224.65 g/mol
LogP1.52
Rot. Bonds2

About 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol

4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol (PubChem CID 105482516) has the molecular formula C10H9ClN2O2 and a molecular weight of 224.65 g/mol. Its IUPAC name is 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol.

Molecular Properties

Compound Name4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol
PubChem CID105482516
Molecular FormulaC10H9ClN2O2
Molecular Weight224.65 g/mol
Exact Mass224.04
IUPAC Name4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol
SMILESOCCc1nc(Cl)c2cc(O)ccc2n1
InChIInChI=1S/C10H9ClN2O2/c11-10-7-5-6(15)1-2-8(7)12-9(13-10)3-4-14/h1-2,5,14-15H,3-4H2
InChIKeyBHCHFFMNMXQAQB-UHFFFAOYSA-N
XLogP1.52
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-chloro-6-methylquinazolin-2-yl)propan-1-ol
CID 105498483
2-(4-amino-6-chloroquinazolin-2-yl)ethanol
CID 105481482
4-chloro-2-cyclopropylquinazolin-6-ol
CID 106584464
4-chloro-6-iodo-2-propylquinazoline
CID 10616606
4-chloro-6-methoxy-2-propylquinazoline
CID 106584452
2-(4-chloro-6-methylquinazolin-2-yl)-N-methylethanamine
CID 105497222
(4,6-dichloroquinazolin-2-yl)methanamine
CID 105485144
4-(aminomethyl)-2-chloroquinazolin-6-ol
CID 105463659
2-(2-chloro-6-hydroxyquinolin-4-yl)acetic acid
CID 84700355
2-(4-chloroquinazolin-2-yl)-N-methylethanamine
CID 105478665
2-(2-chloroquinolin-3-yl)ethanol
CID 116985217
2-(4-amino-6-methoxyquinazolin-2-yl)ethanol
CID 105473832

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol?
The IUPAC name of 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol (CID 105482516) is 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol.
What is the SMILES notation for 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol?
The canonical SMILES for 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol is OCCc1nc(Cl)c2cc(O)ccc2n1.
What is the InChIKey of 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol?
The InChIKey is BHCHFFMNMXQAQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2/c11-10-7-5-6(15)1-2-8(7)12-9(13-10)3-4-14/h1-2,5,14-15H,3-4H2.
What are the key properties of 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol?
4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol has a molecular weight of 224.65 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol is sourced from PubChem (CID 105482516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).