5-prop-2-enyl-4-propyldec-1-ene

C16H30 — CID 173236567

IUPAC5-prop-2-enyl-4-propyldec-1-ene
SMILESC=CCC(CCC)C(CC=C)CCCCC
InChIInChI=1S/C16H30/c1-5-9-10-14-16(13-8-4)15(11-6-2)12-7-3/h6,8,15-16H,2,4-5,7,9-14H2,1,3H3
InChIKeyDBYAVJNUENYVJP-UHFFFAOYSA-N
MW222.42 g/mol
LogP5.75
Rot. Bonds11

About 5-prop-2-enyl-4-propyldec-1-ene

5-prop-2-enyl-4-propyldec-1-ene (PubChem CID 173236567) has the molecular formula C16H30 and a molecular weight of 222.42 g/mol. Its IUPAC name is 5-prop-2-enyl-4-propyldec-1-ene.

Molecular Properties

Compound Name5-prop-2-enyl-4-propyldec-1-ene
PubChem CID173236567
Molecular FormulaC16H30
Molecular Weight222.42 g/mol
Exact Mass222.23
IUPAC Name5-prop-2-enyl-4-propyldec-1-ene
SMILESC=CCC(CCC)C(CC=C)CCCCC
InChIInChI=1S/C16H30/c1-5-9-10-14-16(13-8-4)15(11-6-2)12-7-3/h6,8,15-16H,2,4-5,7,9-14H2,1,3H3
InChIKeyDBYAVJNUENYVJP-UHFFFAOYSA-N
XLogP5.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.42
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

4-propan-2-ylnon-1-ene
CID 173177475
methane;(4R)-4-propan-2-yloct-1-ene
CID 159803024
3-prop-2-enyloctan-2-ol
CID 174661731
4-butan-2-ylheptadec-1-ene
CID 19792906
13-nonyl-14-prop-2-enylhexacosanedioic acid
CID 123780538
5,6-dipropyldec-1-ene
CID 123363407
6,7-dipropyldodecane
CID 529940
4,5-dipropyltetradecane
CID 21490606
8-hexyl-7-propyltriacontane
CID 21490607
7,8-dipropyltetradecane
CID 530307
4-prop-2-enylpentadec-1-ene
CID 54427529
17-prop-2-enyltetratriacontane
CID 173452630

Frequently Asked Questions

What is the IUPAC name of 5-prop-2-enyl-4-propyldec-1-ene?
The IUPAC name of 5-prop-2-enyl-4-propyldec-1-ene (CID 173236567) is 5-prop-2-enyl-4-propyldec-1-ene.
What is the SMILES notation for 5-prop-2-enyl-4-propyldec-1-ene?
The canonical SMILES for 5-prop-2-enyl-4-propyldec-1-ene is C=CCC(CCC)C(CC=C)CCCCC.
What is the InChIKey of 5-prop-2-enyl-4-propyldec-1-ene?
The InChIKey is DBYAVJNUENYVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30/c1-5-9-10-14-16(13-8-4)15(11-6-2)12-7-3/h6,8,15-16H,2,4-5,7,9-14H2,1,3H3.
What are the key properties of 5-prop-2-enyl-4-propyldec-1-ene?
5-prop-2-enyl-4-propyldec-1-ene has a molecular weight of 222.42 g/mol, XLogP of 5.75, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-prop-2-enyl-4-propyldec-1-ene is sourced from PubChem (CID 173236567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).