[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol

C14H16N2OS — CID 62755045

IUPAC[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol
SMILESCc1ccc2c(c1)CCCN2c1ncc(CO)s1
InChIInChI=1S/C14H16N2OS/c1-10-4-5-13-11(7-10)3-2-6-16(13)14-15-8-12(9-17)18-14/h4-5,7-8,17H,2-3,6,9H2,1H3
InChIKeyLVHFGWGRRZZYAH-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.03
Rot. Bonds2

About [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol

[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 62755045) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol
PubChem CID62755045
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol
SMILESCc1ccc2c(c1)CCCN2c1ncc(CO)s1
InChIInChI=1S/C14H16N2OS/c1-10-4-5-13-11(7-10)3-2-6-16(13)14-15-8-12(9-17)18-14/h4-5,7-8,17H,2-3,6,9H2,1H3
InChIKeyLVHFGWGRRZZYAH-UHFFFAOYSA-N
XLogP3.03
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 62765022
1-[5-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propan-1-ol
CID 115940378
2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazole-4-carboxylic acid
CID 80568097
1-[5-(bromomethyl)pyrimidin-2-yl]-6-methyl-3,4-dihydro-2H-quinoline
CID 107079634
[6-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanamine
CID 81249502
5-[(5-methyl-2,3-dihydroindol-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120902127
5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine
CID 80754656
N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 62279125
2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
CID 116796345
N-[[4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine
CID 43281290
N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine
CID 43281288
[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine
CID 24702103

Frequently Asked Questions

What is the IUPAC name of [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol (CID 62755045) is [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol is Cc1ccc2c(c1)CCCN2c1ncc(CO)s1.
What is the InChIKey of [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is LVHFGWGRRZZYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-10-4-5-13-11(7-10)3-2-6-16(13)14-15-8-12(9-17)18-14/h4-5,7-8,17H,2-3,6,9H2,1H3.
What are the key properties of [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol?
[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 260.36 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 62755045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).