4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine

C16H33N — CID 123434402

IUPAC4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine
SMILESC=CC(CCCC(C)C)CCCN(C)CCC
InChIInChI=1S/C16H33N/c1-6-13-17(5)14-9-12-16(7-2)11-8-10-15(3)4/h7,15-16H,2,6,8-14H2,1,3-5H3
InChIKeyTZFXWFOWYWKBAS-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.74
Rot. Bonds11

About 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine

4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine (PubChem CID 123434402) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine.

Molecular Properties

Compound Name4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine
PubChem CID123434402
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC Name4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine
SMILESC=CC(CCCC(C)C)CCCN(C)CCC
InChIInChI=1S/C16H33N/c1-6-13-17(5)14-9-12-16(7-2)11-8-10-15(3)4/h7,15-16H,2,6,8-14H2,1,3-5H3
InChIKeyTZFXWFOWYWKBAS-UHFFFAOYSA-N
XLogP4.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Triethyl(undec-10-enyl)azanium
CID 11551730
2-ethyl-N-(2-ethylhexyl)-N-prop-2-enylhexan-1-amine
CID 87658734
Dioleylpropyl trimethylammonium chloride
CID 129829602
1,2-dilinoleyl-N,N-dimethyl-3-aminopropane
CID 139600217
Piproctanyl
CID 92514
N,N-diethyl-2-methylhept-6-en-1-amine
CID 17824958
N,N-dibutylundec-10-en-1-amine
CID 118629062
[3-Fluoro-3-methyl-2-(2-methylprop-2-enyl)octyl]-trimethylazanium
CID 123867882
N-ethyl-N-(4-fluoro-4-methylpentyl)-9-methyl-8-methylideneoctadecan-1-amine
CID 145405414
N-(6-fluorooctan-4-yl)-N-methyl-11-methylidene-7-propyltridec-12-en-6-amine
CID 170075652
N,N-diethyl-3,7,11-trimethyldodec-1-en-1-amine
CID 170847923
2,3-Dihydro-2-azasqualene
CID 129725423

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine?
The IUPAC name of 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine (CID 123434402) is 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine.
What is the SMILES notation for 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine?
The canonical SMILES for 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine is C=CC(CCCC(C)C)CCCN(C)CCC.
What is the InChIKey of 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine?
The InChIKey is TZFXWFOWYWKBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-6-13-17(5)14-9-12-16(7-2)11-8-10-15(3)4/h7,15-16H,2,6,8-14H2,1,3-5H3.
What are the key properties of 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine?
4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine has a molecular weight of 239.45 g/mol, XLogP of 4.74, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-N,8-dimethyl-N-propylnonan-1-amine is sourced from PubChem (CID 123434402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).