1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene

C10H16N4O2 — CID 70383096

IUPAC1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
SMILESC=C[N+](=O)[O-].CN(C)NCc1cccnc1
InChIInChI=1S/C8H13N3.C2H3NO2/c1-11(2)10-7-8-4-3-5-9-6-8;1-2-3(4)5/h3-6,10H,7H2,1-2H3;2H,1H2
InChIKeyTYBSYOAQLUZZEY-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.05
Rot. Bonds4

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

1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene (PubChem CID 70383096) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene.

Molecular Properties

Compound Name1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
PubChem CID70383096
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
SMILESC=C[N+](=O)[O-].CN(C)NCc1cccnc1
InChIInChI=1S/C8H13N3.C2H3NO2/c1-11(2)10-7-8-4-3-5-9-6-8;1-2-3(4)5/h3-6,10H,7H2,1-2H3;2H,1H2
InChIKeyTYBSYOAQLUZZEY-UHFFFAOYSA-N
XLogP1.05
TPSA71.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.05
H-Bond Donors ≤ 51
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'}

Analyze 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene 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

1-methyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene
CID 70383362
N-(pyridin-3-ylmethyl)prop-2-en-1-amine
CID 4717881
(Z)-1-N'-butyl-1-N'-methyl-2-nitro-1-N-(pyridin-3-ylmethyl)ethene-1,1-diamine
CID 67930871
(E)-N-methyl-1-methylsulfanyl-2-nitro-N-(pyridin-3-ylmethyl)ethenamine
CID 67930851
2-nitro-1-N-(pyridin-3-ylmethyl)-1-N'-(trimethylsilylmethyl)ethene-1,1-diamine
CID 70157675
(E)-1-N,1-N'-dimethyl-2-nitro-1-N'-(2-pyridin-3-ylethyl)ethene-1,1-diamine
CID 70158207
4-N,4-N-dimethyl-5-nitro-6-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine
CID 23481243
(E)-2-nitro-1-N-pentyl-1-N'-(pyridin-3-ylmethyl)ethene-1,1-diamine
CID 15452246
N-methyl-1-pyridin-3-ylmethanamine;hydrochloride
CID 17290665
2-nitro-1-(pyridin-3-ylmethyl)guanidine
CID 173335472
2-methyl-3-nitro-N-(pyridin-3-ylmethyl)benzamide
CID 691924
1-N'-methoxy-1-N-methyl-2-nitro-1-N'-(pyridin-3-ylmethyl)ethene-1,1-diamine
CID 59896622

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
The IUPAC name of 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene (CID 70383096) is 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene.
What is the SMILES notation for 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
The canonical SMILES for 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene is C=C[N+](=O)[O-].CN(C)NCc1cccnc1.
What is the InChIKey of 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
The InChIKey is TYBSYOAQLUZZEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.C2H3NO2/c1-11(2)10-7-8-4-3-5-9-6-8;1-2-3(4)5/h3-6,10H,7H2,1-2H3;2H,1H2.
What are the key properties of 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene?
1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene has a molecular weight of 224.26 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-2-(pyridin-3-ylmethyl)hydrazine;1-nitroethene is sourced from PubChem (CID 70383096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).