2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine

C8H14N2 — CID 134511031

IUPAC2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine
SMILESCN(C)NC1=CC=CCC1
InChIInChI=1S/C8H14N2/c1-10(2)9-8-6-4-3-5-7-8/h3-4,6,9H,5,7H2,1-2H3
InChIKeyPKMLNUMJTLEYJL-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.29
Rot. Bonds2

About 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine

2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine (PubChem CID 134511031) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine
PubChem CID134511031
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine
SMILESCN(C)NC1=CC=CCC1
InChIInChI=1S/C8H14N2/c1-10(2)9-8-6-4-3-5-7-8/h3-4,6,9H,5,7H2,1-2H3
InChIKeyPKMLNUMJTLEYJL-UHFFFAOYSA-N
XLogP1.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.29
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine?
The IUPAC name of 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine (CID 134511031) is 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine.
What is the SMILES notation for 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine?
The canonical SMILES for 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine is CN(C)NC1=CC=CCC1.
What is the InChIKey of 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine?
The InChIKey is PKMLNUMJTLEYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-10(2)9-8-6-4-3-5-7-8/h3-4,6,9H,5,7H2,1-2H3.
What are the key properties of 2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine?
2-cyclohexa-1,3-dien-1-yl-1,1-dimethylhydrazine has a molecular weight of 138.21 g/mol, XLogP of 1.29, 2 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-yl-1,1-dimethylhydrazine is sourced from PubChem (CID 134511031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).