2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine

C9H16N2 — CID 142113090

IUPAC2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine
SMILESCN(C)NCC1=CC=CCC1
InChIInChI=1S/C9H16N2/c1-11(2)10-8-9-6-4-3-5-7-9/h3-4,6,10H,5,7-8H2,1-2H3
InChIKeyINXJNOKDUQGTPZ-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.33
Rot. Bonds3

About 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine

2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine (PubChem CID 142113090) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine
PubChem CID142113090
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine
SMILESCN(C)NCC1=CC=CCC1
InChIInChI=1S/C9H16N2/c1-11(2)10-8-9-6-4-3-5-7-9/h3-4,6,10H,5,7-8H2,1-2H3
InChIKeyINXJNOKDUQGTPZ-UHFFFAOYSA-N
XLogP1.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[[(5R)-6-fluoro-5-methylcyclohexa-1,3-dien-1-yl]methyl]-1,2-dimethylhydrazine
CID 166651439
CID 59855740
CID 59855740
2-(2-Cyclopenta-1,3-dien-1-ylethyl)-1,1-dimethylhydrazine
CID 68162210
Cyclohexa-1,3-dien-1-ylmethylhydrazine
CID 68231546
2-ethyl-1-methyl-1-[(2E,4E)-octa-2,4-dienyl]hydrazine
CID 87095749
2-ethyl-1-methyl-1-[(5E)-octa-5,7-dienyl]hydrazine
CID 87095774
3-[(1Z)-buta-1,3-dienyl]-2,4-dimethyl-5,6-dihydro-1H-pyridazine
CID 89518302
(6-Methylcyclohexa-1,3-dien-1-yl)methylhydrazine
CID 118508895
(5-Methylcyclohexa-1,3-dien-1-yl)methylhydrazine
CID 121291710
2-(3,4-Dimethylhepta-4,6-dienyl)-1,1-diethylhydrazine
CID 123196619
2-[(3,3-Dimethylcyclohepta-1,4,6-trien-1-yl)methyl]-1,1-dimethylhydrazine
CID 123223270
4-ethyl-N-methyl-3,6-dihydro-2H-pyridin-1-amine
CID 123255221

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine?
The IUPAC name of 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine (CID 142113090) is 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine.
What is the SMILES notation for 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine?
The canonical SMILES for 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine is CN(C)NCC1=CC=CCC1.
What is the InChIKey of 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine?
The InChIKey is INXJNOKDUQGTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-11(2)10-8-9-6-4-3-5-7-9/h3-4,6,10H,5,7-8H2,1-2H3.
What are the key properties of 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine?
2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine has a molecular weight of 152.24 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexa-1,3-dien-1-ylmethyl)-1,1-dimethylhydrazine is sourced from PubChem (CID 142113090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).