3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine

C13H19N — CID 91204887

IUPAC3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine
SMILESCCC(C)=C(C)C=C1C=CC(C)=NC1
InChIInChI=1S/C13H19N/c1-5-10(2)11(3)8-13-7-6-12(4)14-9-13/h6-8H,5,9H2,1-4H3
InChIKeyNEVFZZKQGYUATC-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.69
Rot. Bonds2

About 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine

3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine (PubChem CID 91204887) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine.

Molecular Properties

Compound Name3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine
PubChem CID91204887
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine
SMILESCCC(C)=C(C)C=C1C=CC(C)=NC1
InChIInChI=1S/C13H19N/c1-5-10(2)11(3)8-13-7-6-12(4)14-9-13/h6-8H,5,9H2,1-4H3
InChIKeyNEVFZZKQGYUATC-UHFFFAOYSA-N
XLogP3.69
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2,7-dimethyl-2H-azepine
CID 21672374
(2R)-2,7-dimethyl-2H-azepine
CID 134989460
Dimethyl-(4-methylidenecyclohexa-2,5-dien-1-ylidene)azanium
CID 18457916
2-methyl-2H-indole
CID 58371059
(3Z)-3-[(2Z)-4-fluoropenta-2,4-dienylidene]-6-methyl-2H-pyridine
CID 90145839
(3Z)-3-[(2E)-2-fluorohexa-2,5-dienylidene]-6-methyl-2H-pyridine
CID 130413140
(3E,5E)-7,7,7-trifluoro-3,6-dimethyl-N-prop-2-enylhepta-3,5-dien-2-imine
CID 143684725
(3Z)-3-fluoro-4,5-dimethyl-N-prop-2-enylhexa-3,5-dien-2-imine
CID 166976514
N-(1-fluoroethyl)-6-methylidenecyclohexa-2,4-dien-1-imine
CID 173813481
Dimethyl-(4-propan-2-ylidenecyclohexa-2,5-dien-1-ylidene)azanium
CID 101015672
5-fluoro-3-methyl-2H-indole
CID 95046937
(3Z,5E)-N-[(3E)-3-fluoro-5-methyl-2-methylidenehexa-3,5-dienyl]hepta-3,5-dien-2-imine
CID 178135533

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine?
The IUPAC name of 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine (CID 91204887) is 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine.
What is the SMILES notation for 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine?
The canonical SMILES for 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine is CCC(C)=C(C)C=C1C=CC(C)=NC1.
What is the InChIKey of 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine?
The InChIKey is NEVFZZKQGYUATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-5-10(2)11(3)8-13-7-6-12(4)14-9-13/h6-8H,5,9H2,1-4H3.
What are the key properties of 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine?
3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine has a molecular weight of 189.30 g/mol, XLogP of 3.69, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylpent-2-enylidene)-6-methyl-2H-pyridine is sourced from PubChem (CID 91204887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).