5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine

C10H16N2OS — CID 79775233

IUPAC5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine
SMILESNc1ncc(COC2CCCCC2)s1
InChIInChI=1S/C10H16N2OS/c11-10-12-6-9(14-10)7-13-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,11,12)
InChIKeyOCFDZVKFNNOATF-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.57
Rot. Bonds3

About 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine

5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine (PubChem CID 79775233) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine
PubChem CID79775233
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine
SMILESNc1ncc(COC2CCCCC2)s1
InChIInChI=1S/C10H16N2OS/c11-10-12-6-9(14-10)7-13-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,11,12)
InChIKeyOCFDZVKFNNOATF-UHFFFAOYSA-N
XLogP2.57
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine (CID 79775233) is 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine is Nc1ncc(COC2CCCCC2)s1.
What is the InChIKey of 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine?
The InChIKey is OCFDZVKFNNOATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c11-10-12-6-9(14-10)7-13-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,11,12).
What are the key properties of 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine?
5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine has a molecular weight of 212.32 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexyloxymethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 79775233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).