2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol

C10H16N2OS — CID 64913544

IUPAC2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol
SMILESOC1CCCCC1CNc1nccs1
InChIInChI=1S/C10H16N2OS/c13-9-4-2-1-3-8(9)7-12-10-11-5-6-14-10/h5-6,8-9,13H,1-4,7H2,(H,11,12)
InChIKeyFEAUCTMAWIYVIL-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.11
Rot. Bonds3

About 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol

2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol (PubChem CID 64913544) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol
PubChem CID64913544
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol
SMILESOC1CCCCC1CNc1nccs1
InChIInChI=1S/C10H16N2OS/c13-9-4-2-1-3-8(9)7-12-10-11-5-6-14-10/h5-6,8-9,13H,1-4,7H2,(H,11,12)
InChIKeyFEAUCTMAWIYVIL-UHFFFAOYSA-N
XLogP2.11
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol?
The IUPAC name of 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol (CID 64913544) is 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol is OC1CCCCC1CNc1nccs1.
What is the InChIKey of 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol?
The InChIKey is FEAUCTMAWIYVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c13-9-4-2-1-3-8(9)7-12-10-11-5-6-14-10/h5-6,8-9,13H,1-4,7H2,(H,11,12).
What are the key properties of 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol?
2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol has a molecular weight of 212.32 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,3-thiazol-2-ylamino)methyl]cyclohexan-1-ol is sourced from PubChem (CID 64913544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).