2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol

C13H21N3OS — CID 60714895

IUPAC2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol
SMILESOC1CCCCC1N1CCN(c2nccs2)CC1
InChIInChI=1S/C13H21N3OS/c17-12-4-2-1-3-11(12)15-6-8-16(9-7-15)13-14-5-10-18-13/h5,10-12,17H,1-4,6-9H2
InChIKeyAYWBSYMNVOUWOO-UHFFFAOYSA-N
MW267.40 g/mol
LogP1.57
Rot. Bonds2

About 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol

2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol (PubChem CID 60714895) has the molecular formula C13H21N3OS and a molecular weight of 267.40 g/mol. Its IUPAC name is 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol
PubChem CID60714895
Molecular FormulaC13H21N3OS
Molecular Weight267.40 g/mol
Exact Mass267.14
IUPAC Name2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol
SMILESOC1CCCCC1N1CCN(c2nccs2)CC1
InChIInChI=1S/C13H21N3OS/c17-12-4-2-1-3-11(12)15-6-8-16(9-7-15)13-14-5-10-18-13/h5,10-12,17H,1-4,6-9H2
InChIKeyAYWBSYMNVOUWOO-UHFFFAOYSA-N
XLogP1.57
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclopentane-1-carbonitrile
CID 43291625
2-[4-(oxan-4-yl)piperazin-1-yl]-1,3-thiazole
CID 75496874
4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine
CID 62808150
N-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 94031670
2-(4-piperidin-1-ylpiperidin-1-yl)-1,3-thiazole
CID 172900709
ethane;2-pyrrolidin-1-yl-1,3-thiazole
CID 176952882
cyclopropyl-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 53498835
3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclopentan-1-one
CID 79643158
trans-(1R,2R)-2-(4-methylpiperazin-1-yl)cyclohexan-1-ol
CID 13447994
1-[4-[(1R,2S)-2-hydroxycyclopentyl]piperazin-1-yl]-3-(1,3-thiazol-2-yl)propan-1-one
CID 96500899
trans-(1R,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 10103566
cis-(1S,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 23656399

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol?
The IUPAC name of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol (CID 60714895) is 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol is OC1CCCCC1N1CCN(c2nccs2)CC1.
What is the InChIKey of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol?
The InChIKey is AYWBSYMNVOUWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OS/c17-12-4-2-1-3-11(12)15-6-8-16(9-7-15)13-14-5-10-18-13/h5,10-12,17H,1-4,6-9H2.
What are the key properties of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol?
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol has a molecular weight of 267.40 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol is sourced from PubChem (CID 60714895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).