6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine

C10H13N7O2 — CID 80896602

IUPAC6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine
SMILESNNc1ccc([N+](=O)[O-])c(NCCn2cccn2)n1
InChIInChI=1S/C10H13N7O2/c11-15-9-3-2-8(17(18)19)10(14-9)12-5-7-16-6-1-4-13-16/h1-4,6H,5,7,11H2,(H2,12,14,15)
InChIKeyQHMOWQGIDZXNAS-UHFFFAOYSA-N
MW263.26 g/mol
LogP0.58
Rot. Bonds6

About 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine

6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine (PubChem CID 80896602) has the molecular formula C10H13N7O2 and a molecular weight of 263.26 g/mol. Its IUPAC name is 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine
PubChem CID80896602
Molecular FormulaC10H13N7O2
Molecular Weight263.26 g/mol
Exact Mass263.11
IUPAC Name6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine
SMILESNNc1ccc([N+](=O)[O-])c(NCCn2cccn2)n1
InChIInChI=1S/C10H13N7O2/c11-15-9-3-2-8(17(18)19)10(14-9)12-5-7-16-6-1-4-13-16/h1-4,6H,5,7,11H2,(H2,12,14,15)
InChIKeyQHMOWQGIDZXNAS-UHFFFAOYSA-N
XLogP0.58
TPSA123.93 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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-N-methyl-3-nitro-2-N-(2-pyrazol-1-ylethyl)pyridine-2,6-diamine
CID 80808342
3-nitro-2-N-(2-pyrazol-1-ylethyl)pyridine-2,6-diamine
CID 80809598
N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine
CID 61068526
6-methyl-3-nitro-N-(3-pyrazol-1-ylpropyl)pyridin-2-amine
CID 115714662
3-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]propan-1-ol
CID 80943307
6-hydrazinyl-N-[(2-methylpyrazol-3-yl)methyl]-3-nitropyridin-2-amine
CID 80914200
2-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]ethanesulfonamide
CID 80905959
N-(2,2-dimethylbutyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 103466734
3-nitro-N-(3-pyrazol-1-ylpropyl)pyridin-2-amine
CID 112684451
6-hydrazinyl-N-(3-methylsulfanylpropyl)-3-nitropyridin-2-amine
CID 80912104
6-hydrazinyl-N-[(1-methylpyrazol-3-yl)methyl]-3-nitropyridin-2-amine
CID 82875536

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine?
The IUPAC name of 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine (CID 80896602) is 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine.
What is the SMILES notation for 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine?
The canonical SMILES for 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine is NNc1ccc([N+](=O)[O-])c(NCCn2cccn2)n1.
What is the InChIKey of 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine?
The InChIKey is QHMOWQGIDZXNAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N7O2/c11-15-9-3-2-8(17(18)19)10(14-9)12-5-7-16-6-1-4-13-16/h1-4,6H,5,7,11H2,(H2,12,14,15).
What are the key properties of 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine?
6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine has a molecular weight of 263.26 g/mol, XLogP of 0.58, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-3-nitro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine is sourced from PubChem (CID 80896602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).