[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol

C14H12N2O2S — CID 106926902

IUPAC[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol
SMILESCc1coc(Sc2nc3ccccc3cc2CO)n1
InChIInChI=1S/C14H12N2O2S/c1-9-8-18-14(15-9)19-13-11(7-17)6-10-4-2-3-5-12(10)16-13/h2-6,8,17H,7H2,1H3
InChIKeySWGGQCUHMWXDOK-UHFFFAOYSA-N
MW272.33 g/mol
LogP3.17
Rot. Bonds3

About [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol

[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol (PubChem CID 106926902) has the molecular formula C14H12N2O2S and a molecular weight of 272.33 g/mol. Its IUPAC name is [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol.

Molecular Properties

Compound Name[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol
PubChem CID106926902
Molecular FormulaC14H12N2O2S
Molecular Weight272.33 g/mol
Exact Mass272.06
IUPAC Name[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol
SMILESCc1coc(Sc2nc3ccccc3cc2CO)n1
InChIInChI=1S/C14H12N2O2S/c1-9-8-18-14(15-9)19-13-11(7-17)6-10-4-2-3-5-12(10)16-13/h2-6,8,17H,7H2,1H3
InChIKeySWGGQCUHMWXDOK-UHFFFAOYSA-N
XLogP3.17
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol with MolForge

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Related Compounds

[2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol
CID 106926972
[2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]quinolin-3-yl]methanol
CID 63836117
(2-methylsulfanylquinolin-3-yl)methanol
CID 63835189
[2-(2-chlorophenyl)sulfanylquinolin-3-yl]methanol
CID 63814729
[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-4-yl]methanamine
CID 106923721
N-methyl-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinazolin-2-amine
CID 106928504
[2-(2-methoxyethylsulfanyl)quinolin-3-yl]methanol
CID 55240821
3-[3-(hydroxymethyl)quinolin-2-yl]sulfanyl-4-methyl-1H-1,2,4-triazol-5-one
CID 63835072
[2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]quinolin-3-yl]methanamine
CID 63809665
N-methyl-1-[2-(2-methylfuran-3-yl)sulfanylquinolin-3-yl]methanamine
CID 107783184
[2-(4,6-dimethylpyrimidin-2-yl)sulfanylquinolin-3-yl]methanamine
CID 63808788
[2-(cyclopentylmethylsulfanyl)quinolin-3-yl]methanol
CID 63835635

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol?
The IUPAC name of [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol (CID 106926902) is [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol.
What is the SMILES notation for [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol?
The canonical SMILES for [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol is Cc1coc(Sc2nc3ccccc3cc2CO)n1.
What is the InChIKey of [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol?
The InChIKey is SWGGQCUHMWXDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2S/c1-9-8-18-14(15-9)19-13-11(7-17)6-10-4-2-3-5-12(10)16-13/h2-6,8,17H,7H2,1H3.
What are the key properties of [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol?
[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol has a molecular weight of 272.33 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]quinolin-3-yl]methanol is sourced from PubChem (CID 106926902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).