1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine

C11H22N6S — CID 62244769

IUPAC1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine
SMILESCCN1CCC(N(C)Cc2nnsc2NN)CC1
InChIInChI=1S/C11H22N6S/c1-3-17-6-4-9(5-7-17)16(2)8-10-11(13-12)18-15-14-10/h9,13H,3-8,12H2,1-2H3
InChIKeyPXFKPTHNEDPVHZ-UHFFFAOYSA-N
MW270.41 g/mol
LogP0.74
Rot. Bonds5

About 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine

1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine (PubChem CID 62244769) has the molecular formula C11H22N6S and a molecular weight of 270.41 g/mol. Its IUPAC name is 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine
PubChem CID62244769
Molecular FormulaC11H22N6S
Molecular Weight270.41 g/mol
Exact Mass270.16
IUPAC Name1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine
SMILESCCN1CCC(N(C)Cc2nnsc2NN)CC1
InChIInChI=1S/C11H22N6S/c1-3-17-6-4-9(5-7-17)16(2)8-10-11(13-12)18-15-14-10/h9,13H,3-8,12H2,1-2H3
InChIKeyPXFKPTHNEDPVHZ-UHFFFAOYSA-N
XLogP0.74
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.41
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N,1-dimethylpiperidin-4-amine
CID 62245370
4-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylcyclohexan-1-amine
CID 62244219
4-[[cyclohexyl(methyl)amino]methyl]-N-methylthiadiazol-5-amine
CID 62183035
[4-[(2-ethylpyrrolidin-1-yl)methyl]thiadiazol-5-yl]hydrazine
CID 62245357
4-[[methyl-(4-methylcyclohexyl)amino]methyl]thiadiazol-5-amine
CID 62209667
1-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]-N-methylpiperidin-4-amine
CID 62470814
ethane;N'-(1-ethylpiperidin-4-yl)-N'-methylmethanediamine
CID 142615692
N-[(5-chlorothiadiazol-4-yl)methyl]-N-methyl-1-methylsulfonylpiperidin-4-amine
CID 71970602
[4-[(4-methyl-1,4-diazepan-1-yl)methyl]thiadiazol-5-yl]hydrazine
CID 62245571
3-[ethyl-[(5-hydrazinylthiadiazol-4-yl)methyl]amino]propanenitrile
CID 62244391
[4-[(4-phenylpiperazin-1-yl)methyl]thiadiazol-5-yl]hydrazine
CID 62245568
2-[ethyl-[(5-hydrazinylthiadiazol-4-yl)methyl]amino]-N-methylacetamide
CID 62246445

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine?
The IUPAC name of 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine (CID 62244769) is 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine is CCN1CCC(N(C)Cc2nnsc2NN)CC1.
What is the InChIKey of 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine?
The InChIKey is PXFKPTHNEDPVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6S/c1-3-17-6-4-9(5-7-17)16(2)8-10-11(13-12)18-15-14-10/h9,13H,3-8,12H2,1-2H3.
What are the key properties of 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine?
1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine has a molecular weight of 270.41 g/mol, XLogP of 0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine is sourced from PubChem (CID 62244769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).