(4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol

C14H12N2OS — CID 113451230

IUPAC(4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol
SMILESCc1csc(C(O)c2cccc3ncccc23)n1
InChIInChI=1S/C14H12N2OS/c1-9-8-18-14(16-9)13(17)11-4-2-6-12-10(11)5-3-7-15-12/h2-8,13,17H,1H3
InChIKeyRXSLCFPBLTXNDI-UHFFFAOYSA-N
MW256.33 g/mol
LogP3.08
Rot. Bonds2

About (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol

(4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol (PubChem CID 113451230) has the molecular formula C14H12N2OS and a molecular weight of 256.33 g/mol. Its IUPAC name is (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol.

Molecular Properties

Compound Name(4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol
PubChem CID113451230
Molecular FormulaC14H12N2OS
Molecular Weight256.33 g/mol
Exact Mass256.07
IUPAC Name(4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol
SMILESCc1csc(C(O)c2cccc3ncccc23)n1
InChIInChI=1S/C14H12N2OS/c1-9-8-18-14(16-9)13(17)11-4-2-6-12-10(11)5-3-7-15-12/h2-8,13,17H,1H3
InChIKeyRXSLCFPBLTXNDI-UHFFFAOYSA-N
XLogP3.08
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol
CID 104769588
2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanamine
CID 81231313
(1R)-1-quinolin-5-ylethanol
CID 86326294
1-benzothiophen-3-yl(quinolin-5-yl)methanol
CID 78917707
(5-methylpyrazin-2-yl)-quinolin-5-ylmethanol
CID 105118175
(4-methoxythiophen-2-yl)-quinolin-5-ylmethanol
CID 115826281
quinolin-5-yl(1,3-thiazol-5-yl)methanol
CID 81220526
2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanone
CID 81220404
(5-methyl-2-pyridinyl)-quinolin-5-ylmethanol
CID 81318739
quinolin-5-yl-(2,4,5-trimethylfuran-3-yl)methanol
CID 115826290
(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethanol
CID 115826296
(2,5-dimethylfuran-3-yl)-quinolin-5-ylmethanol
CID 115826245

Frequently Asked Questions

What is the IUPAC name of (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol?
The IUPAC name of (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol (CID 113451230) is (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol.
What is the SMILES notation for (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol?
The canonical SMILES for (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol is Cc1csc(C(O)c2cccc3ncccc23)n1.
What is the InChIKey of (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol?
The InChIKey is RXSLCFPBLTXNDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2OS/c1-9-8-18-14(16-9)13(17)11-4-2-6-12-10(11)5-3-7-15-12/h2-8,13,17H,1H3.
What are the key properties of (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol?
(4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol has a molecular weight of 256.33 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-1,3-thiazol-2-yl)-quinolin-5-ylmethanol is sourced from PubChem (CID 113451230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).