(3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine

C10H16N2 — CID 123813713

IUPAC(3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine
SMILESCC1(C)C=CC=CC(CNN)=C1
InChIInChI=1S/C10H16N2/c1-10(2)6-4-3-5-9(7-10)8-12-11/h3-7,12H,8,11H2,1-2H3
InChIKeyBESSYNNSUVLNNH-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.53
Rot. Bonds2

About (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine

(3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine (PubChem CID 123813713) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine.

Molecular Properties

Compound Name(3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine
PubChem CID123813713
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine
SMILESCC1(C)C=CC=CC(CNN)=C1
InChIInChI=1S/C10H16N2/c1-10(2)6-4-3-5-9(7-10)8-12-11/h3-7,12H,8,11H2,1-2H3
InChIKeyBESSYNNSUVLNNH-UHFFFAOYSA-N
XLogP1.53
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-fluoroethyl)-2-[(Z)-2-methylidenepent-3-enyl]hydrazine
CID 170076809
1-(2-Fluoroethyl)-2-(2-methylidenepent-3-enyl)hydrazine
CID 174096071
[(Z,2E)-2-prop-2-enylidenehex-3-enyl]hydrazine
CID 87415364
[(2E,4Z)-2,6-dimethylocta-2,4,6,7-tetraenyl]hydrazine
CID 89118333
1-methyl-2-[(4Z,6Z)-3-methylideneocta-4,6-dienyl]hydrazine
CID 89140481
1-[(2E,4Z)-2-ethenylhexa-2,4-dienyl]-2-methylhydrazine
CID 89324381
[(3Z)-5-methylhexa-3,5-dien-2-yl]hydrazine
CID 90291952
[(E)-2-ethenylbut-2-enyl]hydrazine
CID 117951228
[(3Z,4Z)-3-ethylidene-6-methylhepta-4,6-dienyl]hydrazine
CID 118362887
1-[(Z)-2-methylidenehex-3-enyl]-2-prop-2-enylhydrazine
CID 121419922
1-[(3,3-Dimethylcyclohepta-1,4,6-trien-1-yl)methyl]-2-methylhydrazine
CID 123192867
2-[(3,3-Dimethylcyclohepta-1,4,6-trien-1-yl)methyl]-1,1-dimethylhydrazine
CID 123223270

Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine?
The IUPAC name of (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine (CID 123813713) is (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine.
What is the SMILES notation for (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine?
The canonical SMILES for (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine is CC1(C)C=CC=CC(CNN)=C1.
What is the InChIKey of (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine?
The InChIKey is BESSYNNSUVLNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-10(2)6-4-3-5-9(7-10)8-12-11/h3-7,12H,8,11H2,1-2H3.
What are the key properties of (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine?
(3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine has a molecular weight of 164.25 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethylcyclohepta-1,4,6-trien-1-yl)methylhydrazine is sourced from PubChem (CID 123813713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).