[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol

C11H18N2OS — CID 62521702

IUPAC[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol
SMILESOCC1(NCc2cscn2)CCCCC1
InChIInChI=1S/C11H18N2OS/c14-8-11(4-2-1-3-5-11)13-6-10-7-15-9-12-10/h7,9,13-14H,1-6,8H2
InChIKeyDWWJGXBRHLUNNU-UHFFFAOYSA-N
MW226.34 g/mol
LogP1.93
Rot. Bonds4

About [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol

[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol (PubChem CID 62521702) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol
PubChem CID62521702
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol
SMILESOCC1(NCc2cscn2)CCCCC1
InChIInChI=1S/C11H18N2OS/c14-8-11(4-2-1-3-5-11)13-6-10-7-15-9-12-10/h7,9,13-14H,1-6,8H2
InChIKeyDWWJGXBRHLUNNU-UHFFFAOYSA-N
XLogP1.93
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1,3-thiazol-4-ylmethylamino)cyclobutane-1-carboxylic acid
CID 81167359
[1-(pyrimidin-4-ylmethylamino)cyclohexyl]methanol
CID 62747313
1-(aminomethyl)-N-(1,3-thiazol-4-ylmethyl)cyclohexane-1-carboxamide
CID 115437889
[1-(1,3-thiazol-5-ylmethylamino)cyclohexyl]methanol
CID 62759471
N-[(1-methylcyclohexyl)methyl]-1-(1,3-thiazol-4-yl)methanamine
CID 103753051
[1-[2-methyl-1-(1,3-thiazol-4-ylmethylamino)propyl]cyclobutyl]methanol
CID 126798808
2-[1-[2-oxo-2-(1,3-thiazol-4-ylmethylamino)ethyl]cyclohexyl]acetic acid
CID 62198087
1-(1,3-thiazol-4-ylmethylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 63823970
[1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methylamino]cyclohexyl]methanol
CID 62521004
4-methyl-N-(1,3-thiazol-4-ylmethyl)oxan-4-amine
CID 115758149
[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol
CID 82866192
[1-[(2-methyl-1,3-thiazol-5-yl)methylamino]cyclopentyl]methanol
CID 62522547

Frequently Asked Questions

What is the IUPAC name of [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol?
The IUPAC name of [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol (CID 62521702) is [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol.
What is the SMILES notation for [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol?
The canonical SMILES for [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol is OCC1(NCc2cscn2)CCCCC1.
What is the InChIKey of [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol?
The InChIKey is DWWJGXBRHLUNNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c14-8-11(4-2-1-3-5-11)13-6-10-7-15-9-12-10/h7,9,13-14H,1-6,8H2.
What are the key properties of [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol?
[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol has a molecular weight of 226.34 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol is sourced from PubChem (CID 62521702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).