1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone

C16H34N6O2 — CID 159416475

IUPAC1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NN)CC1.CNN(C)C1CCN(C(C)=O)CC1
InChIInChI=1S/C9H19N3O.C7H15N3O/c1-8(13)12-6-4-9(5-7-12)11(3)10-2;1-6(11)10-4-2-7(9-8)3-5-10/h9-10H,4-7H2,1-3H3;7,9H,2-5,8H2,1H3
InChIKeyLPFLUMSCLGMIDC-UHFFFAOYSA-N
MW342.49 g/mol
LogP-0.48
Rot. Bonds3

About 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone

1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone (PubChem CID 159416475) has the molecular formula C16H34N6O2 and a molecular weight of 342.49 g/mol. Its IUPAC name is 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone
PubChem CID159416475
Molecular FormulaC16H34N6O2
Molecular Weight342.49 g/mol
Exact Mass342.27
IUPAC Name1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NN)CC1.CNN(C)C1CCN(C(C)=O)CC1
InChIInChI=1S/C9H19N3O.C7H15N3O/c1-8(13)12-6-4-9(5-7-12)11(3)10-2;1-6(11)10-4-2-7(9-8)3-5-10/h9-10H,4-7H2,1-3H3;7,9H,2-5,8H2,1H3
InChIKeyLPFLUMSCLGMIDC-UHFFFAOYSA-N
XLogP-0.48
TPSA93.94 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.49
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(2R)-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-(piperidin-1-ylamino)propan-1-one
CID 23540198
1-[4-(2,2-Dimethylhydrazinyl)piperidin-1-yl]ethanone
CID 83004022
1-(4-Hydrazinylpiperidin-1-yl)propan-1-one
CID 123166892
2-[Amino-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]amino]-1-[4-(dimethylamino)piperidin-1-yl]ethanone
CID 123181399
3-Amino-1-[4-(2-methylhydrazinyl)piperidin-1-yl]propan-1-one
CID 143285916
N-(cyclohexylamino)-N-[1-[1-(2-methylpropanoyl)piperidin-4-yl]piperidin-4-yl]nitrous amide
CID 143591951
2-Amino-1-(4-hydrazinylpiperidin-1-yl)ethanone;ethane
CID 144443973
1-ethylpiperidin-4-amine;N-(1-ethylpiperidin-4-yl)acetamide
CID 157486755
N-(1-acetyl-4-piperidinyl)-4-methyl-1-piperazinamine
CID 2845355
1-[4-(Piperidin-1-ylamino)piperidin-1-yl]ethanone
CID 83006689
1-[4-[(2,6-Dimethylpiperidin-1-yl)amino]piperidin-1-yl]ethanone
CID 83007223
N,N-dimethyl-2-[4-(piperidin-1-ylamino)piperidin-1-yl]acetamide
CID 83007786

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone?
The IUPAC name of 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone (CID 159416475) is 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone?
The canonical SMILES for 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone is CC(=O)N1CCC(NN)CC1.CNN(C)C1CCN(C(C)=O)CC1.
What is the InChIKey of 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone?
The InChIKey is LPFLUMSCLGMIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O.C7H15N3O/c1-8(13)12-6-4-9(5-7-12)11(3)10-2;1-6(11)10-4-2-7(9-8)3-5-10/h9-10H,4-7H2,1-3H3;7,9H,2-5,8H2,1H3.
What are the key properties of 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone?
1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone has a molecular weight of 342.49 g/mol, XLogP of -0.48, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydrazinylpiperidin-1-yl)ethanone;1-[4-[methyl(methylamino)amino]piperidin-1-yl]ethanone is sourced from PubChem (CID 159416475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).