[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine

C13H21N5O2 — CID 80913752

IUPAC[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
SMILESCCC1(C)CCN(c2nc(NN)ccc2[N+](=O)[O-])CC1
InChIInChI=1S/C13H21N5O2/c1-3-13(2)6-8-17(9-7-13)12-10(18(19)20)4-5-11(15-12)16-14/h4-5H,3,6-9,14H2,1-2H3,(H,15,16)
InChIKeyTUOGHUHDIGBMLY-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.29
Rot. Bonds4

About [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine

[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine (PubChem CID 80913752) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
PubChem CID80913752
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC Name[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
SMILESCCC1(C)CCN(c2nc(NN)ccc2[N+](=O)[O-])CC1
InChIInChI=1S/C13H21N5O2/c1-3-13(2)6-8-17(9-7-13)12-10(18(19)20)4-5-11(15-12)16-14/h4-5H,3,6-9,14H2,1-2H3,(H,15,16)
InChIKeyTUOGHUHDIGBMLY-UHFFFAOYSA-N
XLogP2.29
TPSA97.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[6-(4,4-dimethylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80918944
[4-(4-ethyl-4-methylpiperidin-1-yl)-5-nitropyrimidin-2-yl]hydrazine
CID 114045026
[6-(4-ethoxypiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80898026
(5-nitro-6-thiomorpholin-4-yl-2-pyridinyl)hydrazine
CID 80932064
[6-(4-methyl-1,4-diazepan-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80931680
1-[6-(ethylamino)-3-nitro-2-pyridinyl]-3-methylpyrrolidin-3-ol
CID 103358849
6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-nitropyridin-2-amine
CID 80835304
N-ethyl-5-nitro-6-thiomorpholin-4-ylpyridin-2-amine
CID 80765652
1-(6-hydrazinyl-3-nitro-2-pyridinyl)piperidin-3-ol
CID 80906785
6-(3,3-diethylpyrrolidin-1-yl)-5-nitropyridin-2-amine
CID 80855316
1-(6-methoxy-3-nitro-2-pyridinyl)-4-methylpiperidin-4-ol
CID 80703735
1-(6-methoxy-3-nitro-2-pyridinyl)-N,4-dimethylpiperidin-4-amine
CID 115323328

Frequently Asked Questions

What is the IUPAC name of [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine?
The IUPAC name of [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine (CID 80913752) is [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine?
The canonical SMILES for [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine is CCC1(C)CCN(c2nc(NN)ccc2[N+](=O)[O-])CC1.
What is the InChIKey of [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine?
The InChIKey is TUOGHUHDIGBMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-3-13(2)6-8-17(9-7-13)12-10(18(19)20)4-5-11(15-12)16-14/h4-5H,3,6-9,14H2,1-2H3,(H,15,16).
What are the key properties of [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine?
[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine has a molecular weight of 279.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine is sourced from PubChem (CID 80913752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).