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

C6H10N4O — CID 118271975

IUPAC1-(triazol-1-yl)pyrrolidin-3-ol
SMILESOC1CCN(n2ccnn2)C1
InChIInChI=1S/C6H10N4O/c11-6-1-3-9(5-6)10-4-2-7-8-10/h2,4,6,11H,1,3,5H2
InChIKeyHYVPMGVOBDHSHD-UHFFFAOYSA-N
MW154.17 g/mol
LogP-1.02
Rot. Bonds1

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

1-(triazol-1-yl)pyrrolidin-3-ol (PubChem CID 118271975) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 1-(triazol-1-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(triazol-1-yl)pyrrolidin-3-ol
PubChem CID118271975
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name1-(triazol-1-yl)pyrrolidin-3-ol
SMILESOC1CCN(n2ccnn2)C1
InChIInChI=1S/C6H10N4O/c11-6-1-3-9(5-6)10-4-2-7-8-10/h2,4,6,11H,1,3,5H2
InChIKeyHYVPMGVOBDHSHD-UHFFFAOYSA-N
XLogP-1.02
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-1.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(triazol-1-yl)pyrrolidin-3-ol?
The IUPAC name of 1-(triazol-1-yl)pyrrolidin-3-ol (CID 118271975) is 1-(triazol-1-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(triazol-1-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-(triazol-1-yl)pyrrolidin-3-ol is OC1CCN(n2ccnn2)C1.
What is the InChIKey of 1-(triazol-1-yl)pyrrolidin-3-ol?
The InChIKey is HYVPMGVOBDHSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c11-6-1-3-9(5-6)10-4-2-7-8-10/h2,4,6,11H,1,3,5H2.
What are the key properties of 1-(triazol-1-yl)pyrrolidin-3-ol?
1-(triazol-1-yl)pyrrolidin-3-ol has a molecular weight of 154.17 g/mol, XLogP of -1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(triazol-1-yl)pyrrolidin-3-ol is sourced from PubChem (CID 118271975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).