1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide

C12H18N6O3 — CID 103198724

IUPAC1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2nc(NN)ccc2[N+](=O)[O-])C1
InChIInChI=1S/C12H18N6O3/c1-14-12(19)8-3-2-6-17(7-8)11-9(18(20)21)4-5-10(15-11)16-13/h4-5,8H,2-3,6-7,13H2,1H3,(H,14,19)(H,15,16)
InChIKeySXVUVXJJJUZXBF-UHFFFAOYSA-N
MW294.31 g/mol
LogP0.24
Rot. Bonds4

About 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide

1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide (PubChem CID 103198724) has the molecular formula C12H18N6O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide
PubChem CID103198724
Molecular FormulaC12H18N6O3
Molecular Weight294.31 g/mol
Exact Mass294.14
IUPAC Name1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2nc(NN)ccc2[N+](=O)[O-])C1
InChIInChI=1S/C12H18N6O3/c1-14-12(19)8-3-2-6-17(7-8)11-9(18(20)21)4-5-10(15-11)16-13/h4-5,8H,2-3,6-7,13H2,1H3,(H,14,19)(H,15,16)
InChIKeySXVUVXJJJUZXBF-UHFFFAOYSA-N
XLogP0.24
TPSA126.42 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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'}

Analyze 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(6-hydrazinyl-3-nitro-2-pyridinyl)piperidin-3-ol
CID 80906785
1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 80905319
1-(6-amino-5-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide
CID 103198490
[6-(4-methyl-1,4-diazepan-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80931680
[6-(4,4-dimethylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80918944
1-(6-hydrazinylpyrazin-2-yl)-N-methylpiperidine-3-carboxamide
CID 103198738
[6-(4-ethoxypiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80898026
[6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-5-nitro-2-pyridinyl]hydrazine
CID 102729208
(5-nitro-6-thiomorpholin-4-yl-2-pyridinyl)hydrazine
CID 80932064
3-amino-2-[3-(methylcarbamoyl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 103197754
2-[1-[6-(methylamino)-3-nitro-2-pyridinyl]pyrrolidin-3-yl]ethanol
CID 114802883
6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-methyl-5-nitropyridin-2-amine
CID 80836942

Frequently Asked Questions

What is the IUPAC name of 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide (CID 103198724) is 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide is CNC(=O)C1CCCN(c2nc(NN)ccc2[N+](=O)[O-])C1.
What is the InChIKey of 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is SXVUVXJJJUZXBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O3/c1-14-12(19)8-3-2-6-17(7-8)11-9(18(20)21)4-5-10(15-11)16-13/h4-5,8H,2-3,6-7,13H2,1H3,(H,14,19)(H,15,16).
What are the key properties of 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide?
1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 0.24, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 103198724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).