2-hydroxypropanoic acid;quinazoline

C11H12N2O3 — CID 157213189

IUPAC2-hydroxypropanoic acid;quinazoline
SMILESCC(O)C(=O)O.c1ccc2ncncc2c1
InChIInChI=1S/C8H6N2.C3H6O3/c1-2-4-8-7(3-1)5-9-6-10-8;1-2(4)3(5)6/h1-6H;2,4H,1H3,(H,5,6)
InChIKeyASCUMSIYSJXTSL-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.08
Rot. Bonds1

About 2-hydroxypropanoic acid;quinazoline

2-hydroxypropanoic acid;quinazoline (PubChem CID 157213189) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 2-hydroxypropanoic acid;quinazoline.

Molecular Properties

Compound Name2-hydroxypropanoic acid;quinazoline
PubChem CID157213189
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name2-hydroxypropanoic acid;quinazoline
SMILESCC(O)C(=O)O.c1ccc2ncncc2c1
InChIInChI=1S/C8H6N2.C3H6O3/c1-2-4-8-7(3-1)5-9-6-10-8;1-2(4)3(5)6/h1-6H;2,4H,1H3,(H,5,6)
InChIKeyASCUMSIYSJXTSL-UHFFFAOYSA-N
XLogP1.08
TPSA83.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-3-methylbutanoic acid;quinazoline
CID 67038235
quinazoline;sulfuric acid
CID 68666384
pyridine;quinazoline;hydrofluoride
CID 159567796
phenanthrene;quinazoline
CID 175352249
N,N-dimethylnitramide;quinazoline
CID 18176213
acetic acid;quinazolin-6-ol
CID 68538754
oxalonitrile;pyridine;quinazoline;hydrochloride;hydrofluoride
CID 158007828
ethane;tetrakis(2-methylpropane);1,5-naphthyridine;1,8-naphthyridine;quinazoline;quinoline
CID 159253000
2,1-benzothiazole;quinazoline
CID 145320674
pyridine;pentakis(1H-pyrrole);quinazoline
CID 161401177
2-cyanoguanidine;quinazoline
CID 87079296
1H-pyrazole;quinazoline
CID 157207291

Frequently Asked Questions

What is the IUPAC name of 2-hydroxypropanoic acid;quinazoline?
The IUPAC name of 2-hydroxypropanoic acid;quinazoline (CID 157213189) is 2-hydroxypropanoic acid;quinazoline.
What is the SMILES notation for 2-hydroxypropanoic acid;quinazoline?
The canonical SMILES for 2-hydroxypropanoic acid;quinazoline is CC(O)C(=O)O.c1ccc2ncncc2c1.
What is the InChIKey of 2-hydroxypropanoic acid;quinazoline?
The InChIKey is ASCUMSIYSJXTSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2.C3H6O3/c1-2-4-8-7(3-1)5-9-6-10-8;1-2(4)3(5)6/h1-6H;2,4H,1H3,(H,5,6).
What are the key properties of 2-hydroxypropanoic acid;quinazoline?
2-hydroxypropanoic acid;quinazoline has a molecular weight of 220.23 g/mol, XLogP of 1.08, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypropanoic acid;quinazoline is sourced from PubChem (CID 157213189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).