5-ethyl-2-methylnon-1-ene

C12H24 — CID 23205953

IUPAC5-ethyl-2-methylnon-1-ene
SMILESC=C(C)CCC(CC)CCCC
InChIInChI=1S/C12H24/c1-5-7-8-12(6-2)10-9-11(3)4/h12H,3,5-10H2,1-2,4H3
InChIKeyZKIDCFZEIQWHHT-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.56
Rot. Bonds7

About 5-ethyl-2-methylnon-1-ene

5-ethyl-2-methylnon-1-ene (PubChem CID 23205953) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 5-ethyl-2-methylnon-1-ene.

Molecular Properties

Compound Name5-ethyl-2-methylnon-1-ene
PubChem CID23205953
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name5-ethyl-2-methylnon-1-ene
SMILESC=C(C)CCC(CC)CCCC
InChIInChI=1S/C12H24/c1-5-7-8-12(6-2)10-9-11(3)4/h12H,3,5-10H2,1-2,4H3
InChIKeyZKIDCFZEIQWHHT-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

7-ethyl-2-methylundec-1-en-5-one
CID 139807060
14-ethyl-11-methylideneoctacosane
CID 142291477
6-ethyl-2-methyldec-1-en-5-amine
CID 105039210
5-ethylundecan-2-one
CID 90150873
ethane;ethene;2-methylhex-1-ene;octane;6-pentylundecane
CID 177138791
4-ethylnonanethioic S-acid
CID 57093694
5-ethylnonane;5-propylnonane
CID 157441807
2-(3-ethylheptyl)-4-methylidenepent-2-enedioic acid
CID 87395007
2-methylhex-1-ene
CID 158402499
7-ethyl-3-methylundecane
CID 57085432
3-(4-methylpenta-1,4-dien-2-yloxymethyl)heptane
CID 88563765
4-ethyloctyl 2-methylprop-2-enoate
CID 57022473

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methylnon-1-ene?
The IUPAC name of 5-ethyl-2-methylnon-1-ene (CID 23205953) is 5-ethyl-2-methylnon-1-ene.
What is the SMILES notation for 5-ethyl-2-methylnon-1-ene?
The canonical SMILES for 5-ethyl-2-methylnon-1-ene is C=C(C)CCC(CC)CCCC.
What is the InChIKey of 5-ethyl-2-methylnon-1-ene?
The InChIKey is ZKIDCFZEIQWHHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-7-8-12(6-2)10-9-11(3)4/h12H,3,5-10H2,1-2,4H3.
What are the key properties of 5-ethyl-2-methylnon-1-ene?
5-ethyl-2-methylnon-1-ene has a molecular weight of 168.32 g/mol, XLogP of 4.56, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methylnon-1-ene is sourced from PubChem (CID 23205953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).