N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine

C11H15N7O2 — CID 107465281

IUPACN-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine
SMILESCCc1nn(C)cc1Nc1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C11H15N7O2/c1-3-7-8(6-17(2)16-7)13-11-9(18(19)20)4-5-10(14-11)15-12/h4-6H,3,12H2,1-2H3,(H2,13,14,15)
InChIKeyIFYHSTXQDLZMFX-UHFFFAOYSA-N
MW277.29 g/mol
LogP1.31
Rot. Bonds5

About N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine

N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine (PubChem CID 107465281) has the molecular formula C11H15N7O2 and a molecular weight of 277.29 g/mol. Its IUPAC name is N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine.

Molecular Properties

Compound NameN-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine
PubChem CID107465281
Molecular FormulaC11H15N7O2
Molecular Weight277.29 g/mol
Exact Mass277.13
IUPAC NameN-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine
SMILESCCc1nn(C)cc1Nc1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C11H15N7O2/c1-3-7-8(6-17(2)16-7)13-11-9(18(19)20)4-5-10(14-11)15-12/h4-6H,3,12H2,1-2H3,(H2,13,14,15)
InChIKeyIFYHSTXQDLZMFX-UHFFFAOYSA-N
XLogP1.31
TPSA123.93 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 51.31
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

N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
N-(2-ethoxyphenyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 80911491
N-[(1,3-dimethylpyrazol-4-yl)methyl]-6-hydrazinyl-3-nitropyridin-2-amine
CID 115991964
3-ethyl-N-(3-hydrazinyl-5-nitrophenyl)-1-methylpyrazol-4-amine
CID 107465279
5-[(3-ethyl-1-methylpyrazol-4-yl)amino]-2-nitrobenzoic acid
CID 107463417
6-hydrazinyl-N-[(1-methylpyrazol-3-yl)methyl]-3-nitropyridin-2-amine
CID 82875536
5-chloro-N-(3-ethyl-1-methylpyrazol-4-yl)-3-nitropyridin-2-amine
CID 103908163
N-(3-ethyl-1-methylpyrazol-4-yl)-2-nitropyridin-3-amine
CID 113349603
N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinylpyrazin-2-amine
CID 107465301
N-(5-chloro-2-methoxyphenyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 80912402
N-(2,2-dimethylbutyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 103466734
(3-ethyl-1-methylpyrazol-4-yl)hydrazine
CID 107462607

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine?
The IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine (CID 107465281) is N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine.
What is the SMILES notation for N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine?
The canonical SMILES for N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine is CCc1nn(C)cc1Nc1nc(NN)ccc1[N+](=O)[O-].
What is the InChIKey of N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine?
The InChIKey is IFYHSTXQDLZMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O2/c1-3-7-8(6-17(2)16-7)13-11-9(18(19)20)4-5-10(14-11)15-12/h4-6H,3,12H2,1-2H3,(H2,13,14,15).
What are the key properties of N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine?
N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine has a molecular weight of 277.29 g/mol, XLogP of 1.31, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine is sourced from PubChem (CID 107465281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).