(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol

C14H22O — CID 25209926

IUPAC(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol
SMILESC=C1CC/C=C(\C)CC/C=C(\C)CC1O
InChIInChI=1S/C14H22O/c1-11-6-4-8-12(2)10-14(15)13(3)9-5-7-11/h7-8,14-15H,3-6,9-10H2,1-2H3/b11-7+,12-8+
InChIKeyNWBFVPGCVIAARR-MKICQXMISA-N
MW206.33 g/mol
LogP3.76
Rot. Bonds

About (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol

(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol (PubChem CID 25209926) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol.

Molecular Properties

Compound Name(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol
PubChem CID25209926
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol
SMILESC=C1CC/C=C(\C)CC/C=C(\C)CC1O
InChIInChI=1S/C14H22O/c1-11-6-4-8-12(2)10-14(15)13(3)9-5-7-11/h7-8,14-15H,3-6,9-10H2,1-2H3/b11-7+,12-8+
InChIKeyNWBFVPGCVIAARR-MKICQXMISA-N
XLogP3.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(1E,5E)-1,5,9-trimethylcyclododeca-1,5,9-triene
CID 139597866
(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol
CID 163074958
(1S,3E,7E,11E)-3,7,11-trimethyl-14-prop-1-en-2-ylcyclotetradeca-3,7,11-trien-1-ol
CID 14217911
(1R,7R)-4,10-dimethyl-14-methylidene-7-prop-1-en-2-ylcyclotetradeca-4,10-dien-1-ol
CID 162887924
5-hydroxy-10-methyl-3,6-dimethylidene-4,5,7,8,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
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CID 91416681
2-[(1R,3E,7E,10R)-10-hydroxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid
CID 90657347
4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-10-ol
CID 162863170
(1R,2R,6E,10R)-7,11,11-trimethyl-3-methylidenebicyclo[8.1.0]undec-6-en-2-ol
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1-methylcyclobutene;sulfane
CID 90109296
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Frequently Asked Questions

What is the IUPAC name of (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol?
The IUPAC name of (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol (CID 25209926) is (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol.
What is the SMILES notation for (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol?
The canonical SMILES for (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol is C=C1CC/C=C(\C)CC/C=C(\C)CC1O.
What is the InChIKey of (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol?
The InChIKey is NWBFVPGCVIAARR-MKICQXMISA-N. The full InChI is InChI=1S/C14H22O/c1-11-6-4-8-12(2)10-14(15)13(3)9-5-7-11/h7-8,14-15H,3-6,9-10H2,1-2H3/b11-7+,12-8+.
What are the key properties of (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol?
(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol has a molecular weight of 206.33 g/mol, XLogP of 3.76, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol is sourced from PubChem (CID 25209926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).