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

C6H11ClN4O — CID 19006006

IUPAC4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride
SMILESCl.OC1CNCC1n1ccnn1
InChIInChI=1S/C6H10N4O.ClH/c11-6-4-7-3-5(6)10-2-1-8-9-10;/h1-2,5-7,11H,3-4H2;1H
InChIKeyQPOPOZYGTWDBTI-UHFFFAOYSA-N
MW190.63 g/mol
LogP-0.79
Rot. Bonds1

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

4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride (PubChem CID 19006006) has the molecular formula C6H11ClN4O and a molecular weight of 190.63 g/mol. Its IUPAC name is 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride.

Molecular Properties

Compound Name4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride
PubChem CID19006006
Molecular FormulaC6H11ClN4O
Molecular Weight190.63 g/mol
Exact Mass190.06
IUPAC Name4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride
SMILESCl.OC1CNCC1n1ccnn1
InChIInChI=1S/C6H10N4O.ClH/c11-6-4-7-3-5(6)10-2-1-8-9-10;/h1-2,5-7,11H,3-4H2;1H
InChIKeyQPOPOZYGTWDBTI-UHFFFAOYSA-N
XLogP-0.79
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.63
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride 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

rac-(3R,4R)-4-(1H-1,2,3-triazol-1-yl)pyrrolidin-3-ol
CID 67820055
3-[(1H-1,2,3-triazol-1-yl)methyl]pyrrolidin-3-ol
CID 122156743
1-amino-3-(1H-1,2,3-triazol-1-yl)propan-2-ol
CID 18765667
4-(1H-1,2,3-triazol-1-yl)pyrrolidin-3-ol
CID 19006007
(3S,4S)-4-(1H-1,2,3-Triazol-1-yl)pyrrolidin-3-ol
CID 45083067
trans-4-(1H-1,2,3-Triazol-1-yl)pyrrolidin-3-ol hydrochloride
CID 67820051
trans-3-Hydroxy-4-(1,2,3-triazol-1-yl)-pyrrolidine hydrochloride
CID 67820054
(3S)-4-(triazol-1-yl)pyrrolidin-3-ol
CID 67990536
2,4-Bis(triazol-1-yl)pentan-3-ol
CID 69410092
2,3-Bis(triazol-1-yl)propan-1-ol
CID 118272391
(3S)-3-amino-1-(triazol-1-yl)butan-2-ol
CID 118525660
(3S,4S)-4-(4-methyltriazol-1-yl)pyrrolidin-3-ol
CID 129236205

Frequently Asked Questions

What is the IUPAC name of 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride?
The IUPAC name of 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride (CID 19006006) is 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride.
What is the SMILES notation for 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride?
The canonical SMILES for 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride is Cl.OC1CNCC1n1ccnn1.
What is the InChIKey of 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride?
The InChIKey is QPOPOZYGTWDBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O.ClH/c11-6-4-7-3-5(6)10-2-1-8-9-10;/h1-2,5-7,11H,3-4H2;1H.
What are the key properties of 4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride?
4-(triazol-1-yl)pyrrolidin-3-ol;hydrochloride has a molecular weight of 190.63 g/mol, XLogP of -0.79, 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;hydrochloride is sourced from PubChem (CID 19006006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).