2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide

C12H24N4O2 — CID 79409446

IUPAC2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide
SMILESCC(C(=O)NN)C(C)N1CCC(CC(N)=O)CC1
InChIInChI=1S/C12H24N4O2/c1-8(12(18)15-14)9(2)16-5-3-10(4-6-16)7-11(13)17/h8-10H,3-7,14H2,1-2H3,(H2,13,17)(H,15,18)
InChIKeyANWNAMFJNGVOIL-UHFFFAOYSA-N
MW256.35 g/mol
LogP-0.41
Rot. Bonds5

About 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide

2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide (PubChem CID 79409446) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide
PubChem CID79409446
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC Name2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide
SMILESCC(C(=O)NN)C(C)N1CCC(CC(N)=O)CC1
InChIInChI=1S/C12H24N4O2/c1-8(12(18)15-14)9(2)16-5-3-10(4-6-16)7-11(13)17/h8-10H,3-7,14H2,1-2H3,(H2,13,17)(H,15,18)
InChIKeyANWNAMFJNGVOIL-UHFFFAOYSA-N
XLogP-0.41
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide (CID 79409446) is 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide is CC(C(=O)NN)C(C)N1CCC(CC(N)=O)CC1.
What is the InChIKey of 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide?
The InChIKey is ANWNAMFJNGVOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-8(12(18)15-14)9(2)16-5-3-10(4-6-16)7-11(13)17/h8-10H,3-7,14H2,1-2H3,(H2,13,17)(H,15,18).
What are the key properties of 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide?
2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide has a molecular weight of 256.35 g/mol, XLogP of -0.41, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-hydrazinyl-3-methyl-4-oxobutan-2-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 79409446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).