2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol

C12H21N5O — CID 62470861

IUPAC2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol
SMILESNNc1ncccc1CN1CCN(CCO)CC1
InChIInChI=1S/C12H21N5O/c13-15-12-11(2-1-3-14-12)10-17-6-4-16(5-7-17)8-9-18/h1-3,18H,4-10,13H2,(H,14,15)
InChIKeyXFWGTRRBTADHEG-UHFFFAOYSA-N
MW251.33 g/mol
LogP-0.52
Rot. Bonds5

About 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol

2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol (PubChem CID 62470861) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol
PubChem CID62470861
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC Name2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol
SMILESNNc1ncccc1CN1CCN(CCO)CC1
InChIInChI=1S/C12H21N5O/c13-15-12-11(2-1-3-14-12)10-17-6-4-16(5-7-17)8-9-18/h1-3,18H,4-10,13H2,(H,14,15)
InChIKeyXFWGTRRBTADHEG-UHFFFAOYSA-N
XLogP-0.52
TPSA77.65 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[3-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine
CID 62968441
[3-(1,3-dihydroisoindol-2-ylmethyl)-2-pyridinyl]hydrazine
CID 62471914
1-[(2-hydrazinyl-3-pyridinyl)methyl]-N,N-dimethylpiperidin-4-amine
CID 62471319
[3-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]-2-pyridinyl]hydrazine
CID 62471212
2-[1-[(2-hydrazinyl-3-pyridinyl)methyl]piperidin-3-yl]ethanol
CID 107228801
2-[4-[(2-morpholin-4-yl-3-pyridinyl)methyl]piperazin-1-yl]ethanol
CID 173270200
[3-[(4-ethoxypiperidin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 62470788
4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazine-2,6-dione
CID 66062201
2-[4-[(2-hydrazinyl-3-pyridinyl)sulfonyl]-1,4-diazepan-1-yl]ethanol
CID 107223459
[3-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]-2-pyridinyl]hydrazine
CID 79175108
[3-[(3-phenylpyrrolidin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 62472032
2-[4-[(3-methyl-2-pyridinyl)methyl]piperazin-1-yl]ethanol
CID 112550205

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol (CID 62470861) is 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol is NNc1ncccc1CN1CCN(CCO)CC1.
What is the InChIKey of 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol?
The InChIKey is XFWGTRRBTADHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c13-15-12-11(2-1-3-14-12)10-17-6-4-16(5-7-17)8-9-18/h1-3,18H,4-10,13H2,(H,14,15).
What are the key properties of 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol?
2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol has a molecular weight of 251.33 g/mol, XLogP of -0.52, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol is sourced from PubChem (CID 62470861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).