2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol

C11H17N3O — CID 114686755

IUPAC2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol
SMILESCn1nncc1C(O)C1CC2CCC1C2
InChIInChI=1S/C11H17N3O/c1-14-10(6-12-13-14)11(15)9-5-7-2-3-8(9)4-7/h6-9,11,15H,2-5H2,1H3
InChIKeyVYERFOARPJEZCE-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.28
Rot. Bonds2

About 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol

2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol (PubChem CID 114686755) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol.

Molecular Properties

Compound Name2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol
PubChem CID114686755
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol
SMILESCn1nncc1C(O)C1CC2CCC1C2
InChIInChI=1S/C11H17N3O/c1-14-10(6-12-13-14)11(15)9-5-7-2-3-8(9)4-7/h6-9,11,15H,2-5H2,1H3
InChIKeyVYERFOARPJEZCE-UHFFFAOYSA-N
XLogP1.28
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol 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

6-bicyclo[3.1.0]hexanyl-(3-methyltriazol-4-yl)methanol
CID 115835967
(4-ethylcyclohexyl)-(3-methyltriazol-4-yl)methanol
CID 114686506
(2,2-dimethylcyclopentyl)-(3-methyltriazol-4-yl)methanol
CID 107192940
2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanone
CID 114686193
2-bicyclo[2.2.1]heptanyl-(4-bromo-1-ethylpyrazol-5-yl)methanol
CID 114645446
2-bicyclo[2.2.1]heptanyl-(2-chloro-4,5-dimethylphenyl)methanol
CID 115484426
2-bicyclo[2.2.1]heptanyl-(2,5-dibromo-4-methylphenyl)methanol
CID 81473785
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(3-methyltriazol-4-yl)methanamine
CID 105043775
(1R)-1-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethanol
CID 130127391
amino(2-bicyclo[2.2.1]heptanyl)methanol
CID 166969475
1-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethanol
CID 134975675
2-bicyclo[2.2.1]heptanyl-(3-fluoro-2-methoxy-4-pyridinyl)methanol
CID 114270352

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol?
The IUPAC name of 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol (CID 114686755) is 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol.
What is the SMILES notation for 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol?
The canonical SMILES for 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol is Cn1nncc1C(O)C1CC2CCC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol?
The InChIKey is VYERFOARPJEZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-14-10(6-12-13-14)11(15)9-5-7-2-3-8(9)4-7/h6-9,11,15H,2-5H2,1H3.
What are the key properties of 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol?
2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol has a molecular weight of 207.28 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]heptanyl-(3-methyltriazol-4-yl)methanol is sourced from PubChem (CID 114686755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).