3,4-diethyldec-3-en-5-yne

C14H24 — CID 10750287

IUPAC3,4-diethyldec-3-en-5-yne
SMILESCCCCC#CC(CC)=C(CC)CC
InChIInChI=1S/C14H24/c1-5-9-10-11-12-14(8-4)13(6-2)7-3/h5-10H2,1-4H3
InChIKeyDGMLKLKXKIIMDQ-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.71
Rot. Bonds5

About 3,4-diethyldec-3-en-5-yne

3,4-diethyldec-3-en-5-yne (PubChem CID 10750287) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 3,4-diethyldec-3-en-5-yne.

Molecular Properties

Compound Name3,4-diethyldec-3-en-5-yne
PubChem CID10750287
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name3,4-diethyldec-3-en-5-yne
SMILESCCCCC#CC(CC)=C(CC)CC
InChIInChI=1S/C14H24/c1-5-9-10-11-12-14(8-4)13(6-2)7-3/h5-10H2,1-4H3
InChIKeyDGMLKLKXKIIMDQ-UHFFFAOYSA-N
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3,4-Diethyl-3-hexene
CID 136668
3-Ethyl-2-methyl-2-pentene
CID 140592
(3E)-4-Ethyl-3-nonen-5-yne
CID 5368780
3-Hexene, 3-ethyl-4-methyl-
CID 142781
5,6-Dimethylhept-5-en-1-yne
CID 85563048
4-Ethylnon-3-en-5-yne
CID 564545
(6E)-2,6-dimethyldodeca-2,6-dien-10-yne
CID 138970676
2-Hexen-4-yne, 2-methyl-3-(1-methylethyl)-
CID 144376
(Z)-6-ethyl-5-iodododec-5-en-7-yne
CID 10471117
1-Methyl-2-oct-1-ynylcyclobutene
CID 10773623
(4E,6E)-4,5,6,7-tetramethyldeca-4,6-dien-2,8-diyne
CID 12461986
(z)-3,4-Dipropylhex-3-ene-1,5-diyne
CID 12585185

Frequently Asked Questions

What is the IUPAC name of 3,4-diethyldec-3-en-5-yne?
The IUPAC name of 3,4-diethyldec-3-en-5-yne (CID 10750287) is 3,4-diethyldec-3-en-5-yne.
What is the SMILES notation for 3,4-diethyldec-3-en-5-yne?
The canonical SMILES for 3,4-diethyldec-3-en-5-yne is CCCCC#CC(CC)=C(CC)CC.
What is the InChIKey of 3,4-diethyldec-3-en-5-yne?
The InChIKey is DGMLKLKXKIIMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-5-9-10-11-12-14(8-4)13(6-2)7-3/h5-10H2,1-4H3.
What are the key properties of 3,4-diethyldec-3-en-5-yne?
3,4-diethyldec-3-en-5-yne has a molecular weight of 192.35 g/mol, XLogP of 4.71, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diethyldec-3-en-5-yne is sourced from PubChem (CID 10750287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).