[1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol

C10H15ClN2OS — CID 130804289

IUPAC[1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol
SMILESCC1CC(CO)CN(c2nc(Cl)cs2)C1
InChIInChI=1S/C10H15ClN2OS/c1-7-2-8(5-14)4-13(3-7)10-12-9(11)6-15-10/h6-8,14H,2-5H2,1H3
InChIKeyGBONREFLQNHVFR-UHFFFAOYSA-N
MW246.76 g/mol
LogP2.25
Rot. Bonds2

About [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol

[1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol (PubChem CID 130804289) has the molecular formula C10H15ClN2OS and a molecular weight of 246.76 g/mol. Its IUPAC name is [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol
PubChem CID130804289
Molecular FormulaC10H15ClN2OS
Molecular Weight246.76 g/mol
Exact Mass246.06
IUPAC Name[1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol
SMILESCC1CC(CO)CN(c2nc(Cl)cs2)C1
InChIInChI=1S/C10H15ClN2OS/c1-7-2-8(5-14)4-13(3-7)10-12-9(11)6-15-10/h6-8,14H,2-5H2,1H3
InChIKeyGBONREFLQNHVFR-UHFFFAOYSA-N
XLogP2.25
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.76
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chloro-1,3-thiazol-2-yl)-4-methylpyrrolidin-3-amine
CID 103577689
2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-4-chloro-1,3-thiazole
CID 130714926
4-chloro-2-(3,4-dimethylpiperazin-1-yl)-1,3-thiazole
CID 83155623
(3S)-1-(4-chloro-1,3-thiazol-2-yl)pyrrolidin-3-ol
CID 104892830
4-chloro-2-(4-propylpiperidin-1-yl)-1,3-thiazole
CID 83155979
2-[2-(3,5-dimethylpiperidin-1-yl)-1,3-thiazol-4-yl]acetic acid
CID 80575566
1-(4-chloro-1,3-thiazol-2-yl)-3-methylpiperidin-4-amine
CID 83155920
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-4-carboxylic acid
CID 130700102
2-(azepan-1-yl)-4-chloro-1,3-thiazole
CID 83155585
[(3R)-1-(6-chloro-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
CID 129393742
1-(4-chloro-1,3-thiazol-2-yl)-1,4-diazepan-6-ol
CID 130542427
1-(4-chloro-1,3-thiazol-2-yl)-N,N-dimethylpiperidin-3-amine
CID 83157211

Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol?
The IUPAC name of [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol (CID 130804289) is [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol.
What is the SMILES notation for [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol?
The canonical SMILES for [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol is CC1CC(CO)CN(c2nc(Cl)cs2)C1.
What is the InChIKey of [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol?
The InChIKey is GBONREFLQNHVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2OS/c1-7-2-8(5-14)4-13(3-7)10-12-9(11)6-15-10/h6-8,14H,2-5H2,1H3.
What are the key properties of [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol?
[1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol has a molecular weight of 246.76 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-1,3-thiazol-2-yl)-5-methylpiperidin-3-yl]methanol is sourced from PubChem (CID 130804289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).