[6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine

C13H13N5O2 — CID 80911841

IUPAC[6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine
SMILESNNc1ccc([N+](=O)[O-])c(N2CCc3ccccc32)n1
InChIInChI=1S/C13H13N5O2/c14-16-12-6-5-11(18(19)20)13(15-12)17-8-7-9-3-1-2-4-10(9)17/h1-6H,7-8,14H2,(H,15,16)
InChIKeyMETBFZZJABZFSB-UHFFFAOYSA-N
MW271.28 g/mol
LogP1.97
Rot. Bonds3

About [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine

[6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine (PubChem CID 80911841) has the molecular formula C13H13N5O2 and a molecular weight of 271.28 g/mol. Its IUPAC name is [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine
PubChem CID80911841
Molecular FormulaC13H13N5O2
Molecular Weight271.28 g/mol
Exact Mass271.11
IUPAC Name[6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine
SMILESNNc1ccc([N+](=O)[O-])c(N2CCc3ccccc32)n1
InChIInChI=1S/C13H13N5O2/c14-16-12-6-5-11(18(19)20)13(15-12)17-8-7-9-3-1-2-4-10(9)17/h1-6H,7-8,14H2,(H,15,16)
InChIKeyMETBFZZJABZFSB-UHFFFAOYSA-N
XLogP1.97
TPSA97.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 51.97
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'}

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Related Compounds

[6-(4-methyl-1,4-diazepan-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80931680
(5-nitro-6-thiomorpholin-4-yl-2-pyridinyl)hydrazine
CID 80932064
4-(2,3-dihydroindol-1-yl)-3-nitroaniline
CID 82299179
[6-(4,4-dimethylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80918944
6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitropyridin-2-amine
CID 80751116
[6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-5-nitro-2-pyridinyl]hydrazine
CID 102729208
[6-(4-ethoxypiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80898026
1-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)-2,3-dihydroindole
CID 23481699
1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 80905319
[5-nitro-6-(1,2,4-triazol-1-yl)-2-pyridinyl]hydrazine
CID 80902448
[6-(4-ethyl-4-methylpiperidin-1-yl)-5-nitro-2-pyridinyl]hydrazine
CID 80913752
1-(6-hydrazinyl-3-nitro-2-pyridinyl)piperidin-3-ol
CID 80906785

Frequently Asked Questions

What is the IUPAC name of [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine?
The IUPAC name of [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine (CID 80911841) is [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine?
The canonical SMILES for [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine is NNc1ccc([N+](=O)[O-])c(N2CCc3ccccc32)n1.
What is the InChIKey of [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine?
The InChIKey is METBFZZJABZFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O2/c14-16-12-6-5-11(18(19)20)13(15-12)17-8-7-9-3-1-2-4-10(9)17/h1-6H,7-8,14H2,(H,15,16).
What are the key properties of [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine?
[6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine has a molecular weight of 271.28 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3-dihydroindol-1-yl)-5-nitro-2-pyridinyl]hydrazine is sourced from PubChem (CID 80911841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).