6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine

C12H19N5O2 — CID 80943738

IUPAC6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine
SMILESCC1CCCCC1Nc1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C12H19N5O2/c1-8-4-2-3-5-9(8)14-12-10(17(18)19)6-7-11(15-12)16-13/h6-9H,2-5,13H2,1H3,(H2,14,15,16)
InChIKeyAQAOFQWZCCBTLW-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.27
Rot. Bonds4

About 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine

6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine (PubChem CID 80943738) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine
PubChem CID80943738
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine
SMILESCC1CCCCC1Nc1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C12H19N5O2/c1-8-4-2-3-5-9(8)14-12-10(17(18)19)6-7-11(15-12)16-13/h6-9H,2-5,13H2,1H3,(H2,14,15,16)
InChIKeyAQAOFQWZCCBTLW-UHFFFAOYSA-N
XLogP2.27
TPSA106.11 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.27
H-Bond Donors ≤ 53
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-hydrazinyl-N-(2-methylsulfanylcyclopentyl)-3-nitropyridin-2-amine
CID 114122174
2-[[6-(methylamino)-3-nitro-2-pyridinyl]amino]cyclohexan-1-ol
CID 80827369
N-(3,3-dimethylcyclopentyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 114542334
2-[[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 80915820
5-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]-1-methylpiperidin-2-one
CID 80915009
2-[(6-amino-3-nitro-2-pyridinyl)amino]cyclohexan-1-ol
CID 80827019
N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
6-methoxy-N-(2-methylpiperidin-3-yl)-3-nitropyridin-2-amine
CID 114695495
6-[(2,3-dimethylcyclohexyl)amino]-5-nitropyridine-2-carboxylic acid
CID 114403458
4-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]pyrrolidin-2-one
CID 106198856
6-hydrazinyl-N-[2-(3-methylcyclohexyl)ethyl]-3-nitropyridin-2-amine
CID 80906290
N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-3-nitropyridin-2-amine
CID 11938982

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine?
The IUPAC name of 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine (CID 80943738) is 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine is CC1CCCCC1Nc1nc(NN)ccc1[N+](=O)[O-].
What is the InChIKey of 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine?
The InChIKey is AQAOFQWZCCBTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-8-4-2-3-5-9(8)14-12-10(17(18)19)6-7-11(15-12)16-13/h6-9H,2-5,13H2,1H3,(H2,14,15,16).
What are the key properties of 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine?
6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine has a molecular weight of 265.32 g/mol, XLogP of 2.27, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-methylcyclohexyl)-3-nitropyridin-2-amine is sourced from PubChem (CID 80943738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).