3-(2-hydroxyethyl)-7-methylquinazolin-4-one

C11H12N2O2 — CID 117264165

IUPAC3-(2-hydroxyethyl)-7-methylquinazolin-4-one
SMILESCc1ccc2c(=O)n(CCO)cnc2c1
InChIInChI=1S/C11H12N2O2/c1-8-2-3-9-10(6-8)12-7-13(4-5-14)11(9)15/h2-3,6-7,14H,4-5H2,1H3
InChIKeyUJYQGZFVRJFZAK-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.70
Rot. Bonds2

About 3-(2-hydroxyethyl)-7-methylquinazolin-4-one

3-(2-hydroxyethyl)-7-methylquinazolin-4-one (PubChem CID 117264165) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-7-methylquinazolin-4-one.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-7-methylquinazolin-4-one
PubChem CID117264165
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name3-(2-hydroxyethyl)-7-methylquinazolin-4-one
SMILESCc1ccc2c(=O)n(CCO)cnc2c1
InChIInChI=1S/C11H12N2O2/c1-8-2-3-9-10(6-8)12-7-13(4-5-14)11(9)15/h2-3,6-7,14H,4-5H2,1H3
InChIKeyUJYQGZFVRJFZAK-UHFFFAOYSA-N
XLogP0.70
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-aminoethyl)-7-methylquinazolin-4-one
CID 117264406
3-(7-methyl-4-oxoquinazolin-3-yl)propanoic acid
CID 117264503
3-(2-hydroxypropyl)-7-methylquinazolin-4-one
CID 117264166
3-(2-hydroxyethyl)-7-[4-(2-methyl-4-pyridinyl)piperazin-1-yl]quinazolin-4-one
CID 126898638
3-(2-chloroethyl)-8-methylpyrimido[5,4-c]quinolin-4-one
CID 53376674
3-(2-hydroxyethyl)-7-(4-methylsulfonylpiperazin-1-yl)quinazolin-4-one
CID 126898605
3-(2-hydroxyethyl)-7-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]quinazolin-4-one
CID 126898635
3-(2-hydroxyethyl)-7-(4-pyrimidin-2-ylpiperazin-1-yl)quinazolin-4-one
CID 126898623
3-[2-(2,4-dimethylphenyl)-2-oxoethyl]-7-fluoroquinazolin-4-one
CID 40743761
3-ethyl-6-methylquinazolin-4-one
CID 70641598
3-(2-hydroxyethyl)-7-[4-(2-methoxyethyl)piperazin-1-yl]quinazolin-4-one
CID 126898641
7-chloro-3-[(4-methylphenyl)methyl]quinazolin-4-one
CID 853041

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethyl)-7-methylquinazolin-4-one?
The IUPAC name of 3-(2-hydroxyethyl)-7-methylquinazolin-4-one (CID 117264165) is 3-(2-hydroxyethyl)-7-methylquinazolin-4-one.
What is the SMILES notation for 3-(2-hydroxyethyl)-7-methylquinazolin-4-one?
The canonical SMILES for 3-(2-hydroxyethyl)-7-methylquinazolin-4-one is Cc1ccc2c(=O)n(CCO)cnc2c1.
What is the InChIKey of 3-(2-hydroxyethyl)-7-methylquinazolin-4-one?
The InChIKey is UJYQGZFVRJFZAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-8-2-3-9-10(6-8)12-7-13(4-5-14)11(9)15/h2-3,6-7,14H,4-5H2,1H3.
What are the key properties of 3-(2-hydroxyethyl)-7-methylquinazolin-4-one?
3-(2-hydroxyethyl)-7-methylquinazolin-4-one has a molecular weight of 204.23 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethyl)-7-methylquinazolin-4-one is sourced from PubChem (CID 117264165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).