2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide

C11H23N3O3 — CID 107229100

IUPAC2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide
SMILESCOCC(C(=O)NN)N1CCCC(CCO)C1
InChIInChI=1S/C11H23N3O3/c1-17-8-10(11(16)13-12)14-5-2-3-9(7-14)4-6-15/h9-10,15H,2-8,12H2,1H3,(H,13,16)
InChIKeyKMOLODUYYBSPAN-UHFFFAOYSA-N
MW245.32 g/mol
LogP-0.91
Rot. Bonds6

About 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide

2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide (PubChem CID 107229100) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide.

Molecular Properties

Compound Name2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide
PubChem CID107229100
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide
SMILESCOCC(C(=O)NN)N1CCCC(CCO)C1
InChIInChI=1S/C11H23N3O3/c1-17-8-10(11(16)13-12)14-5-2-3-9(7-14)4-6-15/h9-10,15H,2-8,12H2,1H3,(H,13,16)
InChIKeyKMOLODUYYBSPAN-UHFFFAOYSA-N
XLogP-0.91
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-2-[3-(methoxymethyl)piperidin-1-yl]propanehydrazide
CID 106589687
3-methoxy-2-(2-methyl-1,4-oxazepan-4-yl)propanehydrazide
CID 103229582
2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-3-methoxypropanehydrazide
CID 103229530
3-methoxy-2-(4-methylpiperidin-1-yl)propanehydrazide
CID 103229441
ethyl 2-[3-(2-hydroxyethyl)piperidin-1-yl]butanoate
CID 64663422
2-(3-ethylpiperidin-1-yl)butanehydrazide
CID 63572940
3-methoxy-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)propanehydrazide
CID 103229742
2-(4-acetylpiperazin-1-yl)-3-methoxypropanehydrazide
CID 103229435
3-methoxy-2-piperazin-1-ylpropanehydrazide
CID 103229611
3-methoxy-2-(2-methylazepan-1-yl)propanehydrazide
CID 103229712
2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-propylpropanamide
CID 62358014
methyl 2-[3-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetate
CID 107228466

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide?
The IUPAC name of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide (CID 107229100) is 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide.
What is the SMILES notation for 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide?
The canonical SMILES for 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide is COCC(C(=O)NN)N1CCCC(CCO)C1.
What is the InChIKey of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide?
The InChIKey is KMOLODUYYBSPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-17-8-10(11(16)13-12)14-5-2-3-9(7-14)4-6-15/h9-10,15H,2-8,12H2,1H3,(H,13,16).
What are the key properties of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide?
2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide has a molecular weight of 245.32 g/mol, XLogP of -0.91, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide is sourced from PubChem (CID 107229100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).