2-(cyclohexyloxymethyl)triazol-4-amine

C9H16N4O — CID 165473073

IUPAC2-(cyclohexyloxymethyl)triazol-4-amine
SMILESNc1cnn(COC2CCCCC2)n1
InChIInChI=1S/C9H16N4O/c10-9-6-11-13(12-9)7-14-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,10,12)
InChIKeyFKKCJTDYLSQHIR-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.17
Rot. Bonds3

About 2-(cyclohexyloxymethyl)triazol-4-amine

2-(cyclohexyloxymethyl)triazol-4-amine (PubChem CID 165473073) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-(cyclohexyloxymethyl)triazol-4-amine.

Molecular Properties

Compound Name2-(cyclohexyloxymethyl)triazol-4-amine
PubChem CID165473073
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-(cyclohexyloxymethyl)triazol-4-amine
SMILESNc1cnn(COC2CCCCC2)n1
InChIInChI=1S/C9H16N4O/c10-9-6-11-13(12-9)7-14-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,10,12)
InChIKeyFKKCJTDYLSQHIR-UHFFFAOYSA-N
XLogP1.17
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-cyclopentyloxyethyl)-5-methylpyrazol-4-amine
CID 165480190
2-heptyltriazol-4-amine
CID 165480790
(1R)-1-[3-(2-cyclopentyloxyethyl)imidazol-4-yl]ethanamine
CID 104943161
6-(cycloheptyloxymethyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 63221063
5-(cycloheptyloxymethyl)-1-methylpyrazole-4-carboxylic acid
CID 116629723
2-(2,2-difluoroethyl)triazol-4-amine
CID 146075351
2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine
CID 78988775
2-[2-(2-aminoethyl)cyclohexyl]triazol-4-amine
CID 112546087
2-(3-propan-2-yloxypropyl)triazol-4-amine
CID 165480310
1-(2-cyclobutyloxyethyl)pyrazol-4-amine
CID 62137723
2-[(5-methylthiophen-3-yl)methyl]triazol-4-amine
CID 165481339
2-[[2-(methoxymethyl)-1,3-thiazol-5-yl]methyl]triazol-4-amine
CID 67958100

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexyloxymethyl)triazol-4-amine?
The IUPAC name of 2-(cyclohexyloxymethyl)triazol-4-amine (CID 165473073) is 2-(cyclohexyloxymethyl)triazol-4-amine.
What is the SMILES notation for 2-(cyclohexyloxymethyl)triazol-4-amine?
The canonical SMILES for 2-(cyclohexyloxymethyl)triazol-4-amine is Nc1cnn(COC2CCCCC2)n1.
What is the InChIKey of 2-(cyclohexyloxymethyl)triazol-4-amine?
The InChIKey is FKKCJTDYLSQHIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c10-9-6-11-13(12-9)7-14-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,10,12).
What are the key properties of 2-(cyclohexyloxymethyl)triazol-4-amine?
2-(cyclohexyloxymethyl)triazol-4-amine has a molecular weight of 196.25 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexyloxymethyl)triazol-4-amine is sourced from PubChem (CID 165473073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).