1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene

C9H14N4O2 — CID 70383362

IUPAC1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
SMILESC=C[N+](=O)[O-].CNNCc1cccnc1
InChIInChI=1S/C7H11N3.C2H3NO2/c1-8-10-6-7-3-2-4-9-5-7;1-2-3(4)5/h2-5,8,10H,6H2,1H3;2H,1H2
InChIKeyDRQMCAIOPMPJJZ-UHFFFAOYSA-N
MW210.24 g/mol
LogP0.71
Rot. Bonds4

About 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene

1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene (PubChem CID 70383362) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene.

Molecular Properties

Compound Name1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
PubChem CID70383362
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
SMILESC=C[N+](=O)[O-].CNNCc1cccnc1
InChIInChI=1S/C7H11N3.C2H3NO2/c1-8-10-6-7-3-2-4-9-5-7;1-2-3(4)5/h2-5,8,10H,6H2,1H3;2H,1H2
InChIKeyDRQMCAIOPMPJJZ-UHFFFAOYSA-N
XLogP0.71
TPSA80.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
CID 70383096
N-(pyridin-3-ylmethyl)prop-2-en-1-amine
CID 4717881
N-methyl-1-pyridin-3-ylmethanamine;hydrochloride
CID 17290665
2-nitro-1-N-(pyridin-3-ylmethyl)-1-N'-(trimethylsilylmethyl)ethene-1,1-diamine
CID 70157675
(E)-2-nitro-1-N-pentyl-1-N'-(pyridin-3-ylmethyl)ethene-1,1-diamine
CID 15452246
(pyridin-3-ylmethylamino)carbamic acid
CID 154450692
(E)-1-N,1-N'-dimethyl-2-nitro-1-N'-(2-pyridin-3-ylethyl)ethene-1,1-diamine
CID 70158207
(Z)-1-N'-butyl-1-N'-methyl-2-nitro-1-N-(pyridin-3-ylmethyl)ethene-1,1-diamine
CID 67930871
2-nitro-1-(pyridin-3-ylmethyl)guanidine
CID 173335472
1-N'-methoxy-1-N-methyl-2-nitro-1-N'-(pyridin-3-ylmethyl)ethene-1,1-diamine
CID 59896622
2-methyl-3-nitro-N-(pyridin-3-ylmethyl)benzamide
CID 691924
(E)-N-methyl-1-methylsulfanyl-2-nitro-N-(pyridin-3-ylmethyl)ethenamine
CID 67930851

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
The IUPAC name of 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene (CID 70383362) is 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene.
What is the SMILES notation for 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
The canonical SMILES for 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene is C=C[N+](=O)[O-].CNNCc1cccnc1.
What is the InChIKey of 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
The InChIKey is DRQMCAIOPMPJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3.C2H3NO2/c1-8-10-6-7-3-2-4-9-5-7;1-2-3(4)5/h2-5,8,10H,6H2,1H3;2H,1H2.
What are the key properties of 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene has a molecular weight of 210.24 g/mol, XLogP of 0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene is sourced from PubChem (CID 70383362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).