5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide

C11H22N4O3 — CID 2759311

IUPAC5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide
SMILESNNC(=O)CCCC(=O)N1CCN(CCO)CC1
InChIInChI=1S/C11H22N4O3/c12-13-10(17)2-1-3-11(18)15-6-4-14(5-7-15)8-9-16/h16H,1-9,12H2,(H,13,17)
InChIKeyOJFVEXIMVQCQHK-UHFFFAOYSA-N
MW258.32 g/mol
LogP-1.72
Rot. Bonds6

About 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide

5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide (PubChem CID 2759311) has the molecular formula C11H22N4O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide.

Molecular Properties

Compound Name5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide
PubChem CID2759311
Molecular FormulaC11H22N4O3
Molecular Weight258.32 g/mol
Exact Mass258.17
IUPAC Name5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide
SMILESNNC(=O)CCCC(=O)N1CCN(CCO)CC1
InChIInChI=1S/C11H22N4O3/c12-13-10(17)2-1-3-11(18)15-6-4-14(5-7-15)8-9-16/h16H,1-9,12H2,(H,13,17)
InChIKeyOJFVEXIMVQCQHK-UHFFFAOYSA-N
XLogP-1.72
TPSA98.90 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 5-1.72
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

5-oxo-5-piperazin-1-ylpentanehydrazide
CID 2760267
5-chloro-1-[4-(2-hydroxyethyl)piperazin-1-yl]pentan-1-one
CID 43578875
1-[4-(2-hydroxyethyl)piperazin-1-yl]decan-1-one
CID 43417107
4-[4-(2-cyanoethyl)piperazin-1-yl]-4-oxobutanehydrazide
CID 4740709
6-amino-1-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]hexan-1-one
CID 107218302
5-(4-propylpiperazin-1-yl)pentanehydrazide
CID 63568646
1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-(1,2,4-triazol-1-yl)butan-1-one
CID 110899775
4-(4-acetylpiperazin-1-yl)-4-oxobutanehydrazide
CID 4739853
5-[4-(4-methylphenyl)piperazin-1-yl]-5-oxopentanehydrazide
CID 4741180
5-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-methylpentan-1-one
CID 82683408
3-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(hydroxymethyl)propanamide
CID 122217061
1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-phenoxybutan-1-one
CID 39161575

Frequently Asked Questions

What is the IUPAC name of 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide?
The IUPAC name of 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide (CID 2759311) is 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide.
What is the SMILES notation for 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide?
The canonical SMILES for 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide is NNC(=O)CCCC(=O)N1CCN(CCO)CC1.
What is the InChIKey of 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide?
The InChIKey is OJFVEXIMVQCQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O3/c12-13-10(17)2-1-3-11(18)15-6-4-14(5-7-15)8-9-16/h16H,1-9,12H2,(H,13,17).
What are the key properties of 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide?
5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide has a molecular weight of 258.32 g/mol, XLogP of -1.72, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanehydrazide is sourced from PubChem (CID 2759311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).