3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine

C16H34N2 — CID 79068358

IUPAC3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine
SMILESC=CCCCC(NC)C(CC)(CC)N(CC)CC
InChIInChI=1S/C16H34N2/c1-7-12-13-14-15(17-6)16(8-2,9-3)18(10-4)11-5/h7,15,17H,1,8-14H2,2-6H3
InChIKeyQYVFXGNSLGRCIC-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.83
Rot. Bonds11

About 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine

3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine (PubChem CID 79068358) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine.

Molecular Properties

Compound Name3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine
PubChem CID79068358
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine
SMILESC=CCCCC(NC)C(CC)(CC)N(CC)CC
InChIInChI=1S/C16H34N2/c1-7-12-13-14-15(17-6)16(8-2,9-3)18(10-4)11-5/h7,15,17H,1,8-14H2,2-6H3
InChIKeyQYVFXGNSLGRCIC-UHFFFAOYSA-N
XLogP3.83
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-N,3-N,3-triethyl-4-N-propylnon-8-ene-3,4-diamine
CID 79067335
3-ethyl-3-N,3-N,4-N-trimethyloct-7-ene-3,4-diamine
CID 79062164
3-ethyl-3-N,3-N-dimethyl-4-N-propylnon-8-ene-3,4-diamine
CID 79061629
1,1,1-trifluoro-N-methylnon-8-en-2-amine
CID 107011900
4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine
CID 79060132
N,3,3-trimethyloct-7-en-4-amine
CID 104987331
2-(diethylamino)-2-methyloct-7-en-3-ol
CID 79054242
3,3-dimethylnon-8-en-4-ylhydrazine
CID 105311424
3-N,3-N,3-triethyl-4-N-propylheptane-3,4-diamine
CID 79067168
3-N,3-N,4-N,3-tetraethyloct-7-yne-3,4-diamine
CID 79067252
2-N,2-N-diethyl-3-N,2-dimethyldodecane-2,3-diamine
CID 79053578
2-N,2-N-diethyl-3-N,2-dimethylnonane-2,3-diamine
CID 79052771

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine?
The IUPAC name of 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine (CID 79068358) is 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine.
What is the SMILES notation for 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine?
The canonical SMILES for 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine is C=CCCCC(NC)C(CC)(CC)N(CC)CC.
What is the InChIKey of 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine?
The InChIKey is QYVFXGNSLGRCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-7-12-13-14-15(17-6)16(8-2,9-3)18(10-4)11-5/h7,15,17H,1,8-14H2,2-6H3.
What are the key properties of 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine?
3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine has a molecular weight of 254.46 g/mol, XLogP of 3.83, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine is sourced from PubChem (CID 79068358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).