N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine

C14H27N — CID 89217463

IUPACN-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine
SMILESC=C(CC(C)(C)C(=C)C)C(CC)NCC
InChIInChI=1S/C14H27N/c1-8-13(15-9-2)12(5)10-14(6,7)11(3)4/h13,15H,3,5,8-10H2,1-2,4,6-7H3
InChIKeyMJBWIMULPCEIFC-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.92
Rot. Bonds7

About N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine

N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine (PubChem CID 89217463) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine.

Molecular Properties

Compound NameN-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine
PubChem CID89217463
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine
SMILESC=C(CC(C)(C)C(=C)C)C(CC)NCC
InChIInChI=1S/C14H27N/c1-8-13(15-9-2)12(5)10-14(6,7)11(3)4/h13,15H,3,5,8-10H2,1-2,4,6-7H3
InChIKeyMJBWIMULPCEIFC-UHFFFAOYSA-N
XLogP3.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Fluoro-2-(3-methylpent-1-en-2-yl)pyrrolidine
CID 123254453
8-fluoro-N,2-dimethyl-3-methylideneoctan-4-amine
CID 134571051
2-(2-Fluoro-2,3-dimethylbut-3-enyl)piperidine
CID 116011052
4-[(1E)-cycloocten-1-yl]-4-methyl-N-propan-2-ylpentan-1-amine
CID 10922993
9,9-Dimethyl-6-methylideneundecan-2-amine
CID 18716549
2-N,4,11,11-tetramethyl-8-methylidenetridecane-2,4-diamine
CID 18716552
2-N,4-dimethyl-8-methylideneundecane-2,4-diamine
CID 18716553
N,9,9-trimethyl-6-methylideneundecan-2-amine
CID 18716554
N-tert-butyl-5,5-dimethyl-4-methylidenehexan-3-amine
CID 20806813
N,3,5,5-Tetramethylcyclohex-2-en-1-amine
CID 21418607
N-(3,3-dimethylbutan-2-yl)-2,4,4-trimethylpent-1-en-3-amine
CID 57660031
(2S,5R)-2-tert-butyl-5-ethenylpyrrolidine
CID 58134999

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine?
The IUPAC name of N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine (CID 89217463) is N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine.
What is the SMILES notation for N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine?
The canonical SMILES for N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine is C=C(CC(C)(C)C(=C)C)C(CC)NCC.
What is the InChIKey of N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine?
The InChIKey is MJBWIMULPCEIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-8-13(15-9-2)12(5)10-14(6,7)11(3)4/h13,15H,3,5,8-10H2,1-2,4,6-7H3.
What are the key properties of N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine?
N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine has a molecular weight of 209.38 g/mol, XLogP of 3.92, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6,6,7-trimethyl-4-methylideneoct-7-en-3-amine is sourced from PubChem (CID 89217463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).