1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide

C13H26N4O2 — CID 63574205

IUPAC1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide
SMILESCCN(CC(=O)N1CCC(C(=O)NN)CC1)C(C)C
InChIInChI=1S/C13H26N4O2/c1-4-16(10(2)3)9-12(18)17-7-5-11(6-8-17)13(19)15-14/h10-11H,4-9,14H2,1-3H3,(H,15,19)
InChIKeyKMVVGDIBCDPHDR-UHFFFAOYSA-N
MW270.38 g/mol
LogP-0.05
Rot. Bonds5

About 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide

1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide (PubChem CID 63574205) has the molecular formula C13H26N4O2 and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide
PubChem CID63574205
Molecular FormulaC13H26N4O2
Molecular Weight270.38 g/mol
Exact Mass270.21
IUPAC Name1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide
SMILESCCN(CC(=O)N1CCC(C(=O)NN)CC1)C(C)C
InChIInChI=1S/C13H26N4O2/c1-4-16(10(2)3)9-12(18)17-7-5-11(6-8-17)13(19)15-14/h10-11H,4-9,14H2,1-3H3,(H,15,19)
InChIKeyKMVVGDIBCDPHDR-UHFFFAOYSA-N
XLogP-0.05
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-ethoxyacetyl)piperidine-4-carbohydrazide
CID 63587204
1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide
CID 63573012
1-[2-[butyl(cyclopropyl)amino]acetyl]piperidine-4-carbohydrazide
CID 63583399
1-[2-(3-methylbutan-2-ylsulfanyl)acetyl]piperidine-4-carbohydrazide
CID 107760970
1-(2-butoxyacetyl)piperidine-4-carbohydrazide
CID 63570869
1-[2-[1-(dimethylamino)propan-2-yl-ethylamino]acetyl]piperidine-4-carboxylic acid
CID 103189745
1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
CID 63568830
1-[2-(2-aminobutylsulfanyl)acetyl]piperidine-4-carbohydrazide
CID 66231444
1-[2-(3-methylmorpholin-4-yl)acetyl]piperidine-4-carbohydrazide
CID 63571429
1-(2,2,3-trimethylbutanoyl)piperidine-4-carbohydrazide
CID 69473843

Frequently Asked Questions

What is the IUPAC name of 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide (CID 63574205) is 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide is CCN(CC(=O)N1CCC(C(=O)NN)CC1)C(C)C.
What is the InChIKey of 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide?
The InChIKey is KMVVGDIBCDPHDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O2/c1-4-16(10(2)3)9-12(18)17-7-5-11(6-8-17)13(19)15-14/h10-11H,4-9,14H2,1-3H3,(H,15,19).
What are the key properties of 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide?
1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide has a molecular weight of 270.38 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63574205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).