(5Z)-3-methylnona-1,5-diene

C10H18 — CID 145064168

IUPAC(5Z)-3-methylnona-1,5-diene
SMILESC=CC(C)C/C=C\CCC
InChIInChI=1S/C10H18/c1-4-6-7-8-9-10(3)5-2/h5,7-8,10H,2,4,6,9H2,1,3H3/b8-7-
InChIKeyYBRWWJFYMTYKHH-FPLPWBNLSA-N
MW138.25 g/mol
LogP3.55
Rot. Bonds5

About (5Z)-3-methylnona-1,5-diene

(5Z)-3-methylnona-1,5-diene (PubChem CID 145064168) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is (5Z)-3-methylnona-1,5-diene.

Molecular Properties

Compound Name(5Z)-3-methylnona-1,5-diene
PubChem CID145064168
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name(5Z)-3-methylnona-1,5-diene
SMILESC=CC(C)C/C=C\CCC
InChIInChI=1S/C10H18/c1-4-6-7-8-9-10(3)5-2/h5,7-8,10H,2,4,6,9H2,1,3H3/b8-7-
InChIKeyYBRWWJFYMTYKHH-FPLPWBNLSA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.55
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

2-bromooct-4-ene
CID 142101254
(1E,3S,5Z)-1-iodo-3-methylnona-1,5-diene
CID 59372903
(3S,5Z)-3-methylhepta-1,5-diene
CID 24884419
3,9-dimethylundeca-1,6-diene
CID 173245384
3,9-dimethyldeca-1,6-diene
CID 173018442
(5Z,7Z)-3-methylnona-1,5,7-triene
CID 142930221
3-methylocta-1,4-diene
CID 123442447
7-prop-2-enyldodec-4-ene
CID 173342323
(4E,6E)-2-methyldeca-4,6-diene
CID 102247745
3-methyltrideca-1,7-diene
CID 173000004
(E,2S,3R)-3-methylnon-5-en-2-ol
CID 122413916
3-methylnon-5-en-2-ol
CID 91526423

Frequently Asked Questions

What is the IUPAC name of (5Z)-3-methylnona-1,5-diene?
The IUPAC name of (5Z)-3-methylnona-1,5-diene (CID 145064168) is (5Z)-3-methylnona-1,5-diene.
What is the SMILES notation for (5Z)-3-methylnona-1,5-diene?
The canonical SMILES for (5Z)-3-methylnona-1,5-diene is C=CC(C)C/C=C\CCC.
What is the InChIKey of (5Z)-3-methylnona-1,5-diene?
The InChIKey is YBRWWJFYMTYKHH-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H18/c1-4-6-7-8-9-10(3)5-2/h5,7-8,10H,2,4,6,9H2,1,3H3/b8-7-.
What are the key properties of (5Z)-3-methylnona-1,5-diene?
(5Z)-3-methylnona-1,5-diene has a molecular weight of 138.25 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-3-methylnona-1,5-diene is sourced from PubChem (CID 145064168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).