2-ethyl-N,5,7-trimethylnon-8-en-1-amine

C14H29N — CID 123592820

IUPAC2-ethyl-N,5,7-trimethylnon-8-en-1-amine
SMILESC=CC(C)CC(C)CCC(CC)CNC
InChIInChI=1S/C14H29N/c1-6-12(3)10-13(4)8-9-14(7-2)11-15-5/h6,12-15H,1,7-11H2,2-5H3
InChIKeySAXHLUHGMZBOSJ-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.86
Rot. Bonds9

About 2-ethyl-N,5,7-trimethylnon-8-en-1-amine

2-ethyl-N,5,7-trimethylnon-8-en-1-amine (PubChem CID 123592820) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 2-ethyl-N,5,7-trimethylnon-8-en-1-amine.

Molecular Properties

Compound Name2-ethyl-N,5,7-trimethylnon-8-en-1-amine
PubChem CID123592820
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name2-ethyl-N,5,7-trimethylnon-8-en-1-amine
SMILESC=CC(C)CC(C)CCC(CC)CNC
InChIInChI=1S/C14H29N/c1-6-12(3)10-13(4)8-9-14(7-2)11-15-5/h6,12-15H,1,7-11H2,2-5H3
InChIKeySAXHLUHGMZBOSJ-UHFFFAOYSA-N
XLogP3.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-Methylundec-10-en-1-amine
CID 13163185
Diallyloctylamine
CID 87161058
2-But-3-enyl-6-fluoro-7-methyloct-7-en-1-amine
CID 123370378
cis-(1S,3R)-3-fluoro-N-methyl-2-(2-methylbut-3-enyl)cyclohexan-1-amine
CID 163693207
4-[(E)-2-fluorobut-1-enyl]-N-methylnonan-1-amine
CID 164053754
5,7-diethyl-4-fluoro-N,8-dimethyldeca-1,8,9-trien-4-amine
CID 166976507
(E,3S,4R)-8-fluoro-N,3,4-trimethylundec-8-en-1-amine
CID 174019251
(3S,4R)-3-ethenyl-2-fluoro-N,4,5-trimethylhexan-1-amine
CID 174091403
2,2-Diallylazacyclotridecane
CID 3640984
3-ethenyl-2,2-dimethyl-N-(2-methylpropyl)hexan-1-amine
CID 10081888
N-[(2S)-2-ethylbut-3-enyl]nonan-1-amine
CID 11031535
2-methyl-N-prop-2-enylhex-5-en-1-amine
CID 11228913

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,5,7-trimethylnon-8-en-1-amine?
The IUPAC name of 2-ethyl-N,5,7-trimethylnon-8-en-1-amine (CID 123592820) is 2-ethyl-N,5,7-trimethylnon-8-en-1-amine.
What is the SMILES notation for 2-ethyl-N,5,7-trimethylnon-8-en-1-amine?
The canonical SMILES for 2-ethyl-N,5,7-trimethylnon-8-en-1-amine is C=CC(C)CC(C)CCC(CC)CNC.
What is the InChIKey of 2-ethyl-N,5,7-trimethylnon-8-en-1-amine?
The InChIKey is SAXHLUHGMZBOSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-6-12(3)10-13(4)8-9-14(7-2)11-15-5/h6,12-15H,1,7-11H2,2-5H3.
What are the key properties of 2-ethyl-N,5,7-trimethylnon-8-en-1-amine?
2-ethyl-N,5,7-trimethylnon-8-en-1-amine has a molecular weight of 211.39 g/mol, XLogP of 3.86, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,5,7-trimethylnon-8-en-1-amine is sourced from PubChem (CID 123592820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).