(3Z)-2,2,7,7-tetramethyl-1,5-diazocine

C10H16N2 — CID 138463401

IUPAC(3Z)-2,2,7,7-tetramethyl-1,5-diazocine
SMILESCC1(C)/C=N\C=C/C(C)(C)/N=C\1
InChIInChI=1S/C10H16N2/c1-9(2)7-11-6-5-10(3,4)12-8-9/h5-8H,1-4H3/b6-5-,11-7-,12-8-
InChIKeyWYQZDQCVEJKVGY-FHJLVZHCSA-N
MW164.25 g/mol
LogP2.46
Rot. Bonds

About (3Z)-2,2,7,7-tetramethyl-1,5-diazocine

(3Z)-2,2,7,7-tetramethyl-1,5-diazocine (PubChem CID 138463401) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (3Z)-2,2,7,7-tetramethyl-1,5-diazocine.

Molecular Properties

Compound Name(3Z)-2,2,7,7-tetramethyl-1,5-diazocine
PubChem CID138463401
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(3Z)-2,2,7,7-tetramethyl-1,5-diazocine
SMILESCC1(C)/C=N\C=C/C(C)(C)/N=C\1
InChIInChI=1S/C10H16N2/c1-9(2)7-11-6-5-10(3,4)12-8-9/h5-8H,1-4H3/b6-5-,11-7-,12-8-
InChIKeyWYQZDQCVEJKVGY-FHJLVZHCSA-N
XLogP2.46
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(Z)-3,3-dimethylbut-1-enyl]-2,2-dimethylpropan-1-imine
CID 59734363
N-[(Z)-3,3-dimethyl-1,2-ditritiobut-1-enyl]-2,2-dimethyl-1-tritiopropan-1-imine
CID 118606013
2,2,7,7-Tetramethyl-1,5-diazocine
CID 123428503
2,2-Dimethyl-7,8-dihydro-1,5-diazonine
CID 123571290
N-[2-methyl-4-(methylideneamino)but-3-en-2-yl]propan-1-imine
CID 124003356
N-[(E)-3,3-dimethylbut-1-enyl]-2,2-dimethylpropan-1-imine
CID 129106669
(3Z)-2,2-dimethyl-1,5-diazacycloocta-3,5,6,8-tetraene
CID 130440432
(Z)-N-ethyl-2,2-dimethyl-N'-propan-2-ylidenebut-3-ene-1,4-diimine
CID 132022210
N-[(Z)-3-(ethylideneamino)-3-methylbut-1-enyl]butan-1-imine
CID 134172389
N-[(Z)-3-(ethylideneamino)-3-methylbut-1-enyl]propan-1-imine
CID 134172396
N'-[(E)-3,3-dimethylbut-1-enyl]-N-methylethane-1,2-diimine
CID 135188941
(4Z,7Z)-3,6,6-trimethylazocin-3-amine
CID 141811698

Frequently Asked Questions

What is the IUPAC name of (3Z)-2,2,7,7-tetramethyl-1,5-diazocine?
The IUPAC name of (3Z)-2,2,7,7-tetramethyl-1,5-diazocine (CID 138463401) is (3Z)-2,2,7,7-tetramethyl-1,5-diazocine.
What is the SMILES notation for (3Z)-2,2,7,7-tetramethyl-1,5-diazocine?
The canonical SMILES for (3Z)-2,2,7,7-tetramethyl-1,5-diazocine is CC1(C)/C=N\C=C/C(C)(C)/N=C\1.
What is the InChIKey of (3Z)-2,2,7,7-tetramethyl-1,5-diazocine?
The InChIKey is WYQZDQCVEJKVGY-FHJLVZHCSA-N. The full InChI is InChI=1S/C10H16N2/c1-9(2)7-11-6-5-10(3,4)12-8-9/h5-8H,1-4H3/b6-5-,11-7-,12-8-.
What are the key properties of (3Z)-2,2,7,7-tetramethyl-1,5-diazocine?
(3Z)-2,2,7,7-tetramethyl-1,5-diazocine has a molecular weight of 164.25 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-2,2,7,7-tetramethyl-1,5-diazocine is sourced from PubChem (CID 138463401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).