(7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine

C10H19N — CID 138527540

IUPAC(7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine
SMILESCN1/C=C\CCCCC1(C)C
InChIInChI=1S/C10H19N/c1-10(2)8-6-4-5-7-9-11(10)3/h7,9H,4-6,8H2,1-3H3/b9-7-
InChIKeyDWVRZBBUNDYPEC-CLFYSBASSA-N
MW153.27 g/mol
LogP2.78
Rot. Bonds

About (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine

(7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine (PubChem CID 138527540) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine.

Molecular Properties

Compound Name(7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine
PubChem CID138527540
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine
SMILESCN1/C=C\CCCCC1(C)C
InChIInChI=1S/C10H19N/c1-10(2)8-6-4-5-7-9-11(10)3/h7,9H,4-6,8H2,1-3H3/b9-7-
InChIKeyDWVRZBBUNDYPEC-CLFYSBASSA-N
XLogP2.78
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,2,7,7-pentamethylazepane
CID 22946774
(7S)-7-methyl-1-azabicyclo[5.1.0]oct-2-ene
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1,2,2,6,6-pentamethylpiperidine
CID 6603
3-fluoro-3-methylcyclooctene
CID 154031859
cyclobutane;cyclobutene;cycloheptane;cycloheptene;cyclohexane;cyclohexene;cyclooctane;cyclooctene;cyclopentane;cyclopentene;ethane
CID 159907930
1,2,2,6,6-pentamethylpiperidine iodide
CID 5315073
cyclotetradeca-1,6-diene
CID 90733243
(1E)-cycloicosa-1,6-diene
CID 173214809
3-methyl-3-methylcyclohexene
CID 163592791
1,2,2-trimethyl-1-azaspiro[4.5]decane
CID 59773900
(1Z)-6,6,9,9-tetramethylcyclododecene
CID 5462910
(1E,7E)-cyclododeca-1,7-diene
CID 6477773

Frequently Asked Questions

What is the IUPAC name of (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine?
The IUPAC name of (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine (CID 138527540) is (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine.
What is the SMILES notation for (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine?
The canonical SMILES for (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine is CN1/C=C\CCCCC1(C)C.
What is the InChIKey of (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine?
The InChIKey is DWVRZBBUNDYPEC-CLFYSBASSA-N. The full InChI is InChI=1S/C10H19N/c1-10(2)8-6-4-5-7-9-11(10)3/h7,9H,4-6,8H2,1-3H3/b9-7-.
What are the key properties of (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine?
(7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine has a molecular weight of 153.27 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7Z)-1,2,2-trimethyl-3,4,5,6-tetrahydroazocine is sourced from PubChem (CID 138527540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).