[1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol

C11H18N4O — CID 102789983

IUPAC[1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol
SMILESCC1CCN(c2cccc(NN)n2)C1CO
InChIInChI=1S/C11H18N4O/c1-8-5-6-15(9(8)7-16)11-4-2-3-10(13-11)14-12/h2-4,8-9,16H,5-7,12H2,1H3,(H,13,14)
InChIKeyPVEGUHOSXACABD-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.57
Rot. Bonds3

About [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol

[1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol (PubChem CID 102789983) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol
PubChem CID102789983
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol
SMILESCC1CCN(c2cccc(NN)n2)C1CO
InChIInChI=1S/C11H18N4O/c1-8-5-6-15(9(8)7-16)11-4-2-3-10(13-11)14-12/h2-4,8-9,16H,5-7,12H2,1H3,(H,13,14)
InChIKeyPVEGUHOSXACABD-UHFFFAOYSA-N
XLogP0.57
TPSA74.41 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.57
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-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol?
The IUPAC name of [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol (CID 102789983) is [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol is CC1CCN(c2cccc(NN)n2)C1CO.
What is the InChIKey of [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol?
The InChIKey is PVEGUHOSXACABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8-5-6-15(9(8)7-16)11-4-2-3-10(13-11)14-12/h2-4,8-9,16H,5-7,12H2,1H3,(H,13,14).
What are the key properties of [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol?
[1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol has a molecular weight of 222.29 g/mol, XLogP of 0.57, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-hydrazinyl-2-pyridinyl)-3-methylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 102789983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).