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

C11H18N2OS — CID 62961190

IUPAC2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
SMILESCCc1csc(NC2CCCCC2O)n1
InChIInChI=1S/C11H18N2OS/c1-2-8-7-15-11(12-8)13-9-5-3-4-6-10(9)14/h7,9-10,14H,2-6H2,1H3,(H,12,13)
InChIKeySGYZYXQRIXVKMN-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.42
Rot. Bonds3

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

2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol (PubChem CID 62961190) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
PubChem CID62961190
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
SMILESCCc1csc(NC2CCCCC2O)n1
InChIInChI=1S/C11H18N2OS/c1-2-8-7-15-11(12-8)13-9-5-3-4-6-10(9)14/h7,9-10,14H,2-6H2,1H3,(H,12,13)
InChIKeySGYZYXQRIXVKMN-UHFFFAOYSA-N
XLogP2.42
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol (CID 62961190) is 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol is CCc1csc(NC2CCCCC2O)n1.
What is the InChIKey of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol?
The InChIKey is SGYZYXQRIXVKMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-2-8-7-15-11(12-8)13-9-5-3-4-6-10(9)14/h7,9-10,14H,2-6H2,1H3,(H,12,13).
What are the key properties of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol?
2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol has a molecular weight of 226.34 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 62961190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).