2-propyldec-9-en-1-amine

C13H27N — CID 87482159

IUPAC2-propyldec-9-en-1-amine
SMILESC=CCCCCCCC(CN)CCC
InChIInChI=1S/C13H27N/c1-3-5-6-7-8-9-11-13(12-14)10-4-2/h3,13H,1,4-12,14H2,2H3
InChIKeyOIJIUIOLOADGSL-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.89
Rot. Bonds10

About 2-propyldec-9-en-1-amine

2-propyldec-9-en-1-amine (PubChem CID 87482159) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 2-propyldec-9-en-1-amine.

Molecular Properties

Compound Name2-propyldec-9-en-1-amine
PubChem CID87482159
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name2-propyldec-9-en-1-amine
SMILESC=CCCCCCCC(CN)CCC
InChIInChI=1S/C13H27N/c1-3-5-6-7-8-9-11-13(12-14)10-4-2/h3,13H,1,4-12,14H2,2H3
InChIKeyOIJIUIOLOADGSL-UHFFFAOYSA-N
XLogP3.89
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

2-butylundec-10-en-1-amine
CID 87482538
2-propylhept-6-en-1-amine
CID 87481724
9-propyldodec-1-ene
CID 174048054
7-propylundec-1-ene
CID 174048285
7-pentyltridec-1-ene
CID 123620244
12-pentyltricosa-1,22-diene
CID 102409743
26-heptadecylnonapentacont-1-ene
CID 123445046
9-butyltetracosane;icosane;oct-1-ene
CID 159857155
7-butylundec-1-ene
CID 174048295
2-propylheptan-1-amine
CID 21267775
8-ethylpentadec-1-ene
CID 91081893
10-ethyldocos-1-ene
CID 91804827

Frequently Asked Questions

What is the IUPAC name of 2-propyldec-9-en-1-amine?
The IUPAC name of 2-propyldec-9-en-1-amine (CID 87482159) is 2-propyldec-9-en-1-amine.
What is the SMILES notation for 2-propyldec-9-en-1-amine?
The canonical SMILES for 2-propyldec-9-en-1-amine is C=CCCCCCCC(CN)CCC.
What is the InChIKey of 2-propyldec-9-en-1-amine?
The InChIKey is OIJIUIOLOADGSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-3-5-6-7-8-9-11-13(12-14)10-4-2/h3,13H,1,4-12,14H2,2H3.
What are the key properties of 2-propyldec-9-en-1-amine?
2-propyldec-9-en-1-amine has a molecular weight of 197.37 g/mol, XLogP of 3.89, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyldec-9-en-1-amine is sourced from PubChem (CID 87482159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).