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

C11H19N3O — CID 107045687

IUPAC1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol
SMILESCn1cc(CC2(O)CCCCCC2)nn1
InChIInChI=1S/C11H19N3O/c1-14-9-10(12-13-14)8-11(15)6-4-2-3-5-7-11/h9,15H,2-8H2,1H3
InChIKeyAWGHXPWUGDXHEW-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.44
Rot. Bonds2

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

1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol (PubChem CID 107045687) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol.

Molecular Properties

Compound Name1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol
PubChem CID107045687
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol
SMILESCn1cc(CC2(O)CCCCCC2)nn1
InChIInChI=1S/C11H19N3O/c1-14-9-10(12-13-14)8-11(15)6-4-2-3-5-7-11/h9,15H,2-8H2,1H3
InChIKeyAWGHXPWUGDXHEW-UHFFFAOYSA-N
XLogP1.44
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
CID 107045659
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]cycloheptan-1-ol?
The IUPAC name of 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol (CID 107045687) is 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol.
What is the SMILES notation for 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol?
The canonical SMILES for 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol is Cn1cc(CC2(O)CCCCCC2)nn1.
What is the InChIKey of 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol?
The InChIKey is AWGHXPWUGDXHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14-9-10(12-13-14)8-11(15)6-4-2-3-5-7-11/h9,15H,2-8H2,1H3.
What are the key properties of 1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol?
1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 1.44, 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]cycloheptan-1-ol is sourced from PubChem (CID 107045687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).