2,4-dimethylidene-1,6-di(propan-2-yl)pyridine

C13H21N — CID 134464269

IUPAC2,4-dimethylidene-1,6-di(propan-2-yl)pyridine
SMILESC=C1C=C(C(C)C)N(C(C)C)C(=C)C1
InChIInChI=1S/C13H21N/c1-9(2)13-8-11(5)7-12(6)14(13)10(3)4/h8-10H,5-7H2,1-4H3
InChIKeyJXXBYMLIDVUFNH-UHFFFAOYSA-N
MW191.32 g/mol
LogP3.71
Rot. Bonds2

About 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine

2,4-dimethylidene-1,6-di(propan-2-yl)pyridine (PubChem CID 134464269) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine.

Molecular Properties

Compound Name2,4-dimethylidene-1,6-di(propan-2-yl)pyridine
PubChem CID134464269
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC Name2,4-dimethylidene-1,6-di(propan-2-yl)pyridine
SMILESC=C1C=C(C(C)C)N(C(C)C)C(=C)C1
InChIInChI=1S/C13H21N/c1-9(2)13-8-11(5)7-12(6)14(13)10(3)4/h8-10H,5-7H2,1-4H3
InChIKeyJXXBYMLIDVUFNH-UHFFFAOYSA-N
XLogP3.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine?
The IUPAC name of 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine (CID 134464269) is 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine.
What is the SMILES notation for 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine?
The canonical SMILES for 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine is C=C1C=C(C(C)C)N(C(C)C)C(=C)C1.
What is the InChIKey of 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine?
The InChIKey is JXXBYMLIDVUFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N/c1-9(2)13-8-11(5)7-12(6)14(13)10(3)4/h8-10H,5-7H2,1-4H3.
What are the key properties of 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine?
2,4-dimethylidene-1,6-di(propan-2-yl)pyridine has a molecular weight of 191.32 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylidene-1,6-di(propan-2-yl)pyridine is sourced from PubChem (CID 134464269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).