(E,5S)-5-methylnon-3-ene

C10H20 — CID 101420891

IUPAC(E,5S)-5-methylnon-3-ene
SMILESCC/C=C/[C@@H](C)CCCC
InChIInChI=1S/C10H20/c1-4-6-8-10(3)9-7-5-2/h6,8,10H,4-5,7,9H2,1-3H3/b8-6+/t10-/m1/s1
InChIKeyRYBGNROWMIQGHS-QEHWCHDUSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds5

About (E,5S)-5-methylnon-3-ene

(E,5S)-5-methylnon-3-ene (PubChem CID 101420891) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is (E,5S)-5-methylnon-3-ene.

Molecular Properties

Compound Name(E,5S)-5-methylnon-3-ene
PubChem CID101420891
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name(E,5S)-5-methylnon-3-ene
SMILESCC/C=C/[C@@H](C)CCCC
InChIInChI=1S/C10H20/c1-4-6-8-10(3)9-7-5-2/h6,8,10H,4-5,7,9H2,1-3H3/b8-6+/t10-/m1/s1
InChIKeyRYBGNROWMIQGHS-QEHWCHDUSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
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

(E)-5-methyldodec-3-ene
CID 173194511
5-methyldodec-6-ene
CID 86165480
5-methylpentadec-6-ene
CID 123440014
4-methyloct-2-ene
CID 528286
7-methylhexadec-5-ene
CID 150059561
(E)-10-methylheptadec-8-ene
CID 10923034
(E,11S)-11-methyltricos-9-ene
CID 163215390
5-methylnon-3-enoic acid
CID 73071370
5-ethylnon-3-ene
CID 91177059
(E)-non-3-en-5-ol
CID 18957163
5,10-dimethylhexadec-8-ene
CID 91557751
(3E)-2,5-dimethylnona-1,3-diene
CID 14899752

Frequently Asked Questions

What is the IUPAC name of (E,5S)-5-methylnon-3-ene?
The IUPAC name of (E,5S)-5-methylnon-3-ene (CID 101420891) is (E,5S)-5-methylnon-3-ene.
What is the SMILES notation for (E,5S)-5-methylnon-3-ene?
The canonical SMILES for (E,5S)-5-methylnon-3-ene is CC/C=C/[C@@H](C)CCCC.
What is the InChIKey of (E,5S)-5-methylnon-3-ene?
The InChIKey is RYBGNROWMIQGHS-QEHWCHDUSA-N. The full InChI is InChI=1S/C10H20/c1-4-6-8-10(3)9-7-5-2/h6,8,10H,4-5,7,9H2,1-3H3/b8-6+/t10-/m1/s1.
What are the key properties of (E,5S)-5-methylnon-3-ene?
(E,5S)-5-methylnon-3-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E,5S)-5-methylnon-3-ene is sourced from PubChem (CID 101420891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).