[1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol

C11H18N4O — CID 79260186

IUPAC[1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
SMILESNNc1ccnc(CN2CCCC2CO)c1
InChIInChI=1S/C11H18N4O/c12-14-9-3-4-13-10(6-9)7-15-5-1-2-11(15)8-16/h3-4,6,11,16H,1-2,5,7-8,12H2,(H,13,14)
InChIKeyYRAAOSPPOLSYTM-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.32
Rot. Bonds4

About [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol

[1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 79260186) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
PubChem CID79260186
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
SMILESNNc1ccnc(CN2CCCC2CO)c1
InChIInChI=1S/C11H18N4O/c12-14-9-3-4-13-10(6-9)7-15-5-1-2-11(15)8-16/h3-4,6,11,16H,1-2,5,7-8,12H2,(H,13,14)
InChIKeyYRAAOSPPOLSYTM-UHFFFAOYSA-N
XLogP0.32
TPSA74.41 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol (CID 79260186) is [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol is NNc1ccnc(CN2CCCC2CO)c1.
What is the InChIKey of [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is YRAAOSPPOLSYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c12-14-9-3-4-13-10(6-9)7-15-5-1-2-11(15)8-16/h3-4,6,11,16H,1-2,5,7-8,12H2,(H,13,14).
What are the key properties of [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol?
[1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 222.29 g/mol, XLogP of 0.32, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 79260186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).