2-(4-amino-6-chloroquinazolin-2-yl)ethanol

C10H10ClN3O — CID 105481482

IUPAC2-(4-amino-6-chloroquinazolin-2-yl)ethanol
SMILESNc1nc(CCO)nc2ccc(Cl)cc12
InChIInChI=1S/C10H10ClN3O/c11-6-1-2-8-7(5-6)10(12)14-9(13-8)3-4-15/h1-2,5,15H,3-4H2,(H2,12,13,14)
InChIKeyTVPLNQRVLOOIFS-UHFFFAOYSA-N
MW223.66 g/mol
LogP1.40
Rot. Bonds2

About 2-(4-amino-6-chloroquinazolin-2-yl)ethanol

2-(4-amino-6-chloroquinazolin-2-yl)ethanol (PubChem CID 105481482) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is 2-(4-amino-6-chloroquinazolin-2-yl)ethanol.

Molecular Properties

Compound Name2-(4-amino-6-chloroquinazolin-2-yl)ethanol
PubChem CID105481482
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC Name2-(4-amino-6-chloroquinazolin-2-yl)ethanol
SMILESNc1nc(CCO)nc2ccc(Cl)cc12
InChIInChI=1S/C10H10ClN3O/c11-6-1-2-8-7(5-6)10(12)14-9(13-8)3-4-15/h1-2,5,15H,3-4H2,(H2,12,13,14)
InChIKeyTVPLNQRVLOOIFS-UHFFFAOYSA-N
XLogP1.40
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-amino-6-methoxyquinazolin-2-yl)ethanol
CID 105473832
6-chloro-2-(methylaminomethyl)quinazolin-4-amine
CID 105480053
4-chloro-2-(2-hydroxyethyl)quinazolin-6-ol
CID 105482516
(4,6-dichloroquinazolin-2-yl)methanamine
CID 105485144
6-chloro-2-cyclopropylquinazolin-4-amine
CID 106583780
(6-chloro-2-propylquinazolin-4-yl)hydrazine
CID 106583784
2,6-bis(chloromethyl)quinazolin-4-amine
CID 91333470
6-chloro-2-(1,1,2,2,2-pentafluoroethyl)quinazolin-4-amine
CID 64983527
6-chloro-2-(5-chlorothiophen-2-yl)quinazolin-4-amine
CID 64983299
6-chloro-2-(1,1,2,2-tetrafluoroethyl)quinazolin-4-amine
CID 79659764
3,6-dichloro-2-methylquinolin-4-amine
CID 121236621
3-(6-chloroquinazolin-2-yl)propan-1-ol
CID 105480030

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-chloroquinazolin-2-yl)ethanol?
The IUPAC name of 2-(4-amino-6-chloroquinazolin-2-yl)ethanol (CID 105481482) is 2-(4-amino-6-chloroquinazolin-2-yl)ethanol.
What is the SMILES notation for 2-(4-amino-6-chloroquinazolin-2-yl)ethanol?
The canonical SMILES for 2-(4-amino-6-chloroquinazolin-2-yl)ethanol is Nc1nc(CCO)nc2ccc(Cl)cc12.
What is the InChIKey of 2-(4-amino-6-chloroquinazolin-2-yl)ethanol?
The InChIKey is TVPLNQRVLOOIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c11-6-1-2-8-7(5-6)10(12)14-9(13-8)3-4-15/h1-2,5,15H,3-4H2,(H2,12,13,14).
What are the key properties of 2-(4-amino-6-chloroquinazolin-2-yl)ethanol?
2-(4-amino-6-chloroquinazolin-2-yl)ethanol has a molecular weight of 223.66 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-chloroquinazolin-2-yl)ethanol is sourced from PubChem (CID 105481482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).