[1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol

C10H18N4O — CID 129496812

IUPAC[1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol
SMILESCCCN1CC[C@H](n2cc(CO)nn2)C1
InChIInChI=1S/C10H18N4O/c1-2-4-13-5-3-10(7-13)14-6-9(8-15)11-12-14/h6,10,15H,2-5,7-8H2,1H3/t10-/m0/s1
InChIKeyXKJCBYDGAMEUDG-JTQLQIEISA-N
MW210.28 g/mol
LogP0.43
Rot. Bonds4

About [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol

[1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol (PubChem CID 129496812) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol.

Molecular Properties

Compound Name[1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol
PubChem CID129496812
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name[1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol
SMILESCCCN1CC[C@H](n2cc(CO)nn2)C1
InChIInChI=1S/C10H18N4O/c1-2-4-13-5-3-10(7-13)14-6-9(8-15)11-12-14/h6,10,15H,2-5,7-8H2,1H3/t10-/m0/s1
InChIKeyXKJCBYDGAMEUDG-JTQLQIEISA-N
XLogP0.43
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-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

[1-[(3R)-1-cyclobutylpiperidin-3-yl]triazol-4-yl]methanol
CID 129344711
[1-[(3R)-1-methylsulfonylpiperidin-3-yl]triazol-4-yl]methanol
CID 129496204
[1-(azetidin-3-yl)triazol-4-yl]methanol
CID 75485535
[1-(thietan-3-yl)triazol-4-yl]methanol
CID 129452279
(1-piperidin-4-yltriazol-4-yl)methanol;hydrochloride
CID 86262656
N-propan-2-yl-1-[(3S)-1-propylpiperidin-3-yl]triazole-4-carboxamide
CID 26343423
N-propan-2-yl-1-[(3R)-1-propylpiperidin-3-yl]triazole-4-carboxamide
CID 26343421
[1-(thiolan-3-yl)triazol-4-yl]methanol
CID 121200365
[1-[(3S)-thiolan-3-yl]triazol-4-yl]methanol
CID 129491102
[1-[(1S,3R)-3-aminocyclopentyl]triazol-4-yl]methanol
CID 165444649
N-methyl-1-[1-[1-(2-methylpentyl)piperidin-4-yl]triazol-4-yl]methanamine
CID 46995833
(1-methyltriazol-4-yl)methanol;tungsten
CID 163298775

Frequently Asked Questions

What is the IUPAC name of [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol?
The IUPAC name of [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol (CID 129496812) is [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol.
What is the SMILES notation for [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol?
The canonical SMILES for [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol is CCCN1CC[C@H](n2cc(CO)nn2)C1.
What is the InChIKey of [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol?
The InChIKey is XKJCBYDGAMEUDG-JTQLQIEISA-N. The full InChI is InChI=1S/C10H18N4O/c1-2-4-13-5-3-10(7-13)14-6-9(8-15)11-12-14/h6,10,15H,2-5,7-8H2,1H3/t10-/m0/s1.
What are the key properties of [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol?
[1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol has a molecular weight of 210.28 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3S)-1-propylpyrrolidin-3-yl]triazol-4-yl]methanol is sourced from PubChem (CID 129496812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).