2-(3,3-dimethylhept-6-enyl)pyridine

C14H21N — CID 91019951

IUPAC2-(3,3-dimethylhept-6-enyl)pyridine
SMILESC=CCCC(C)(C)CCc1ccccn1
InChIInChI=1S/C14H21N/c1-4-5-10-14(2,3)11-9-13-8-6-7-12-15-13/h4,6-8,12H,1,5,9-11H2,2-3H3
InChIKeyWFURDJLISQLEBV-UHFFFAOYSA-N
MW203.33 g/mol
LogP4.01
Rot. Bonds6

About 2-(3,3-dimethylhept-6-enyl)pyridine

2-(3,3-dimethylhept-6-enyl)pyridine (PubChem CID 91019951) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-(3,3-dimethylhept-6-enyl)pyridine.

Molecular Properties

Compound Name2-(3,3-dimethylhept-6-enyl)pyridine
PubChem CID91019951
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-(3,3-dimethylhept-6-enyl)pyridine
SMILESC=CCCC(C)(C)CCc1ccccn1
InChIInChI=1S/C14H21N/c1-4-5-10-14(2,3)11-9-13-8-6-7-12-15-13/h4,6-8,12H,1,5,9-11H2,2-3H3
InChIKeyWFURDJLISQLEBV-UHFFFAOYSA-N
XLogP4.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3S)-3-methyl-5-pyridin-2-ylpent-1-en-3-ol
CID 92532437
2-oct-7-enylpyridine
CID 57031977
2-methyl-4-pyridin-2-ylbutan-2-ol
CID 145217393
2-prop-2-enylpyridine
CID 3015241
2-(5,5-dimethylhexyl)pyridine
CID 151657269
2-(4,4-dimethylhexyl)pyridine
CID 57111041
(2R)-N-(2-pyridin-2-ylethyl)hex-5-en-2-amine
CID 97358782
3,3-dimethyl-4-(2-pyridin-2-ylethylamino)butan-1-ol
CID 106146853
dimethyl(2-pyridin-2-ylethyl)indigane
CID 19877468
1-pyridin-2-yldec-9-en-3-ol
CID 107012287
N-(pyridin-2-ylmethyl)hex-5-en-2-amine
CID 75525482
CID 66669094
CID 66669094

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylhept-6-enyl)pyridine?
The IUPAC name of 2-(3,3-dimethylhept-6-enyl)pyridine (CID 91019951) is 2-(3,3-dimethylhept-6-enyl)pyridine.
What is the SMILES notation for 2-(3,3-dimethylhept-6-enyl)pyridine?
The canonical SMILES for 2-(3,3-dimethylhept-6-enyl)pyridine is C=CCCC(C)(C)CCc1ccccn1.
What is the InChIKey of 2-(3,3-dimethylhept-6-enyl)pyridine?
The InChIKey is WFURDJLISQLEBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-4-5-10-14(2,3)11-9-13-8-6-7-12-15-13/h4,6-8,12H,1,5,9-11H2,2-3H3.
What are the key properties of 2-(3,3-dimethylhept-6-enyl)pyridine?
2-(3,3-dimethylhept-6-enyl)pyridine has a molecular weight of 203.33 g/mol, XLogP of 4.01, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylhept-6-enyl)pyridine is sourced from PubChem (CID 91019951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).