4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol

C10H16N2OS — CID 130730151

IUPAC4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESCc1cc(C2(O)CCC(N)CC2)sn1
InChIInChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(13)4-2-8(11)3-5-10/h6,8,13H,2-5,11H2,1H3
InChIKeyAUZJAJFWSPMXGL-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.54
Rot. Bonds1

About 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol

4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol (PubChem CID 130730151) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol
PubChem CID130730151
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESCc1cc(C2(O)CCC(N)CC2)sn1
InChIInChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(13)4-2-8(11)3-5-10/h6,8,13H,2-5,11H2,1H3
InChIKeyAUZJAJFWSPMXGL-UHFFFAOYSA-N
XLogP1.54
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol?
The IUPAC name of 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol (CID 130730151) is 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol?
The canonical SMILES for 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol is Cc1cc(C2(O)CCC(N)CC2)sn1.
What is the InChIKey of 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol?
The InChIKey is AUZJAJFWSPMXGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(13)4-2-8(11)3-5-10/h6,8,13H,2-5,11H2,1H3.
What are the key properties of 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol?
4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol has a molecular weight of 212.32 g/mol, XLogP of 1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(3-methyl-1,2-thiazol-5-yl)cyclohexan-1-ol is sourced from PubChem (CID 130730151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).