1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide

C11H22N4O3 — CID 63573012

IUPAC1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide
SMILESCN(CCO)CC(=O)N1CCC(C(=O)NN)CC1
InChIInChI=1S/C11H22N4O3/c1-14(6-7-16)8-10(17)15-4-2-9(3-5-15)11(18)13-12/h9,16H,2-8,12H2,1H3,(H,13,18)
InChIKeyHKJHPZNSMISBGO-UHFFFAOYSA-N
MW258.32 g/mol
LogP-1.86
Rot. Bonds5

About 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide

1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide (PubChem CID 63573012) has the molecular formula C11H22N4O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide
PubChem CID63573012
Molecular FormulaC11H22N4O3
Molecular Weight258.32 g/mol
Exact Mass258.17
IUPAC Name1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide
SMILESCN(CCO)CC(=O)N1CCC(C(=O)NN)CC1
InChIInChI=1S/C11H22N4O3/c1-14(6-7-16)8-10(17)15-4-2-9(3-5-15)11(18)13-12/h9,16H,2-8,12H2,1H3,(H,13,18)
InChIKeyHKJHPZNSMISBGO-UHFFFAOYSA-N
XLogP-1.86
TPSA98.90 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 5-1.86
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

2-[[2-[4-(hydrazinecarbonyl)piperidin-1-yl]-2-oxoethyl]-methylamino]acetamide
CID 63574037
1-[2-[cyclopropyl(propyl)amino]acetyl]piperidine-4-carbohydrazide
CID 63572523
1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide
CID 63574205
1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
CID 63568830
1-[2-[butyl(cyclopropyl)amino]acetyl]piperidine-4-carbohydrazide
CID 63583399
1-(2-ethoxyacetyl)piperidine-4-carbohydrazide
CID 63587204
1-(2-butoxyacetyl)piperidine-4-carbohydrazide
CID 63570869
1-[2-(3-hydroxypropylsulfanyl)acetyl]piperidine-4-carbohydrazide
CID 66128765
1-[2-[(2-amino-2-oxoethyl)-methylamino]acetyl]piperidine-4-carboxylic acid
CID 62658956
1-[2-(3-methylbutan-2-ylsulfanyl)acetyl]piperidine-4-carbohydrazide
CID 107760970
1-[2-(3-aminopropylsulfanyl)acetyl]piperidine-4-carbohydrazide
CID 66218506
1-(2-but-2-enoxyacetyl)piperidine-4-carbohydrazide
CID 76999495

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide (CID 63573012) is 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide is CN(CCO)CC(=O)N1CCC(C(=O)NN)CC1.
What is the InChIKey of 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide?
The InChIKey is HKJHPZNSMISBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O3/c1-14(6-7-16)8-10(17)15-4-2-9(3-5-15)11(18)13-12/h9,16H,2-8,12H2,1H3,(H,13,18).
What are the key properties of 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide?
1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide has a molecular weight of 258.32 g/mol, XLogP of -1.86, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63573012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).