4-(triazol-1-yl)pyrrolidin-3-ol

C6H10N4O — CID 19006007

IUPAC4-(triazol-1-yl)pyrrolidin-3-ol
SMILESOC1CNCC1n1ccnn1
InChIInChI=1S/C6H10N4O/c11-6-4-7-3-5(6)10-2-1-8-9-10/h1-2,5-7,11H,3-4H2
InChIKeyHWXNIOPASTVKAY-UHFFFAOYSA-N
MW154.17 g/mol
LogP-1.22
Rot. Bonds1

About 4-(triazol-1-yl)pyrrolidin-3-ol

4-(triazol-1-yl)pyrrolidin-3-ol (PubChem CID 19006007) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 4-(triazol-1-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name4-(triazol-1-yl)pyrrolidin-3-ol
PubChem CID19006007
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name4-(triazol-1-yl)pyrrolidin-3-ol
SMILESOC1CNCC1n1ccnn1
InChIInChI=1S/C6H10N4O/c11-6-4-7-3-5(6)10-2-1-8-9-10/h1-2,5-7,11H,3-4H2
InChIKeyHWXNIOPASTVKAY-UHFFFAOYSA-N
XLogP-1.22
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(triazol-1-yl)pyrrolidin-3-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(triazol-1-yl)pyrrolidin-3-ol?
The IUPAC name of 4-(triazol-1-yl)pyrrolidin-3-ol (CID 19006007) is 4-(triazol-1-yl)pyrrolidin-3-ol.
What is the SMILES notation for 4-(triazol-1-yl)pyrrolidin-3-ol?
The canonical SMILES for 4-(triazol-1-yl)pyrrolidin-3-ol is OC1CNCC1n1ccnn1.
What is the InChIKey of 4-(triazol-1-yl)pyrrolidin-3-ol?
The InChIKey is HWXNIOPASTVKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c11-6-4-7-3-5(6)10-2-1-8-9-10/h1-2,5-7,11H,3-4H2.
What are the key properties of 4-(triazol-1-yl)pyrrolidin-3-ol?
4-(triazol-1-yl)pyrrolidin-3-ol has a molecular weight of 154.17 g/mol, XLogP of -1.22, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(triazol-1-yl)pyrrolidin-3-ol is sourced from PubChem (CID 19006007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).