(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine

C8H12N4O3 — CID 80911273

IUPAC(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine
SMILESCC(C)Oc1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C8H12N4O3/c1-5(2)15-8-6(12(13)14)3-4-7(10-8)11-9/h3-5H,9H2,1-2H3,(H,10,11)
InChIKeyOCFHCKFCVDJZBX-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.06
Rot. Bonds4

About (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine

(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine (PubChem CID 80911273) has the molecular formula C8H12N4O3 and a molecular weight of 212.21 g/mol. Its IUPAC name is (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine.

Molecular Properties

Compound Name(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine
PubChem CID80911273
Molecular FormulaC8H12N4O3
Molecular Weight212.21 g/mol
Exact Mass212.09
IUPAC Name(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine
SMILESCC(C)Oc1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C8H12N4O3/c1-5(2)15-8-6(12(13)14)3-4-7(10-8)11-9/h3-5H,9H2,1-2H3,(H,10,11)
InChIKeyOCFHCKFCVDJZBX-UHFFFAOYSA-N
XLogP1.06
TPSA103.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.06
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'}

Analyze (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine 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

3-nitro-6-propan-2-yloxypyridin-2-amine
CID 14551122
[6-(4-chlorophenoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80915190
[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine
CID 116794577
[6-(4-bromo-2-chlorophenoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80916853
(4-nitro-3-propan-2-yloxyphenyl)hydrazine
CID 83002210
N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
[6-(cyclopentylmethoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80923785
6-hydrazinyl-N-(4-methylhexan-2-yl)-3-nitropyridin-2-amine
CID 80924578
[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine
CID 80925762
6-hydrazinyl-3-nitro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 80902169
2-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]-3-methoxypropan-1-ol
CID 106198965
2-N-(6-hydrazinyl-3-nitro-2-pyridinyl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 80897107

Frequently Asked Questions

What is the IUPAC name of (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine?
The IUPAC name of (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine (CID 80911273) is (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine.
What is the SMILES notation for (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine?
The canonical SMILES for (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine is CC(C)Oc1nc(NN)ccc1[N+](=O)[O-].
What is the InChIKey of (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine?
The InChIKey is OCFHCKFCVDJZBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O3/c1-5(2)15-8-6(12(13)14)3-4-7(10-8)11-9/h3-5H,9H2,1-2H3,(H,10,11).
What are the key properties of (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine?
(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine has a molecular weight of 212.21 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine is sourced from PubChem (CID 80911273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).