1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol

C10H17N3O — CID 107045659

IUPAC1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
SMILESCn1cc(CC2(O)CCCCC2)nn1
InChIInChI=1S/C10H17N3O/c1-13-8-9(11-12-13)7-10(14)5-3-2-4-6-10/h8,14H,2-7H2,1H3
InChIKeyICIRCDGLMRCGOM-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.05
Rot. Bonds2

About 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol

1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol (PubChem CID 107045659) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
PubChem CID107045659
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
SMILESCn1cc(CC2(O)CCCCC2)nn1
InChIInChI=1S/C10H17N3O/c1-13-8-9(11-12-13)7-10(14)5-3-2-4-6-10/h8,14H,2-7H2,1H3
InChIKeyICIRCDGLMRCGOM-UHFFFAOYSA-N
XLogP1.05
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol
CID 107045687
4-[(1-methyltriazol-4-yl)methyl]oxan-4-ol
CID 107045763
1-[(1-methyltriazol-4-yl)methyl]-4-propylcycloheptan-1-ol
CID 107046101
[1-[(1-methyltriazol-4-yl)methyl]cyclooctyl]methanamine
CID 107057461
1-[1-hydroxy-2-(1-methyltriazol-4-yl)ethyl]cycloheptan-1-ol
CID 107048234
2,3-dimethyl-1-[(1-methyltriazol-4-yl)methyl]cyclobutan-1-ol
CID 130674404
1-(1-aminocyclohexyl)-2-(1-methyltriazol-4-yl)ethanone
CID 107061763
2,4-dimethyl-1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
CID 107046074
N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine
CID 107053262
1-(1-ethoxycycloheptyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107048191
2-[(1-methyltriazol-4-yl)methyl]thiolane-2-carboxylic acid
CID 107057541
2-ethyl-1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-amine
CID 107046702

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol (CID 107045659) is 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol is Cn1cc(CC2(O)CCCCC2)nn1.
What is the InChIKey of 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol?
The InChIKey is ICIRCDGLMRCGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-8-9(11-12-13)7-10(14)5-3-2-4-6-10/h8,14H,2-7H2,1H3.
What are the key properties of 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol?
1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 107045659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).