(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol

C13H24O — CID 139824549

IUPAC(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol
SMILESC/C=C\[C@@H](O)C[C@H](C)CCC=C(C)C
InChIInChI=1S/C13H24O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,7-8,12-14H,6,9-10H2,1-4H3/b7-5-/t12-,13-/m1/s1
InChIKeyQIWCWJCPQHLGMF-WFMXKNRHSA-N
MW196.33 g/mol
LogP3.70
Rot. Bonds6

About (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol

(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol (PubChem CID 139824549) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol.

Molecular Properties

Compound Name(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol
PubChem CID139824549
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol
SMILESC/C=C\[C@@H](O)C[C@H](C)CCC=C(C)C
InChIInChI=1S/C13H24O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,7-8,12-14H,6,9-10H2,1-4H3/b7-5-/t12-,13-/m1/s1
InChIKeyQIWCWJCPQHLGMF-WFMXKNRHSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5R)-5,9-dimethyldeca-1,8-dien-3-ol
CID 10986927
(E)-2-methylhept-5-ene-1,4-diol
CID 10606868
2-hydroxy-4,8-dimethylnon-7-enenitrile
CID 59050259
(6E,11E)-2,6,10-trimethyltrideca-2,6,11-triene
CID 148658393
(10S)-2,6,10-trimethyltrideca-2,6,11-triene
CID 57030104
(6S)-6,10-dimethylundeca-1,9-dien-4-ol
CID 11030747
6,10-dimethylundeca-1,9-dien-4-ol
CID 11019804
(6R)-8,8-bis[(3R)-3,7-dimethyloct-6-enoxy]-2,6-dimethyloct-2-ene
CID 87863892
6,10-dimethylundec-9-ene-2,3-dione
CID 91218155
(2R)-2,6-dimethylhept-5-en-1-amine
CID 163211564
3,7-dimethyloct-6-enenitrile
CID 89052536
[(3R)-3,7-dimethyloct-6-enyl] (5S)-3-hydroxy-5,9-dimethyldec-8-enoate
CID 166747683

Frequently Asked Questions

What is the IUPAC name of (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol?
The IUPAC name of (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol (CID 139824549) is (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol.
What is the SMILES notation for (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol?
The canonical SMILES for (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol is C/C=C\[C@@H](O)C[C@H](C)CCC=C(C)C.
What is the InChIKey of (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol?
The InChIKey is QIWCWJCPQHLGMF-WFMXKNRHSA-N. The full InChI is InChI=1S/C13H24O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,7-8,12-14H,6,9-10H2,1-4H3/b7-5-/t12-,13-/m1/s1.
What are the key properties of (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol?
(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol has a molecular weight of 196.33 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol is sourced from PubChem (CID 139824549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).