(3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine

C15H25N — CID 91146280

IUPAC(3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine
SMILESCCC(/C=C1/CC=C(C(C)C)N=C1C)CC
InChIInChI=1S/C15H25N/c1-6-13(7-2)10-14-8-9-15(11(3)4)16-12(14)5/h9-11,13H,6-8H2,1-5H3/b14-10-
InChIKeyJXOOGLNIKULEAG-UVTDQMKNSA-N
MW219.37 g/mol
LogP4.75
Rot. Bonds4

About (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine

(3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine (PubChem CID 91146280) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine.

Molecular Properties

Compound Name(3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine
PubChem CID91146280
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name(3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine
SMILESCCC(/C=C1/CC=C(C(C)C)N=C1C)CC
InChIInChI=1S/C15H25N/c1-6-13(7-2)10-14-8-9-15(11(3)4)16-12(14)5/h9-11,13H,6-8H2,1-5H3/b14-10-
InChIKeyJXOOGLNIKULEAG-UVTDQMKNSA-N
XLogP4.75
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine?
The IUPAC name of (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine (CID 91146280) is (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine.
What is the SMILES notation for (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine?
The canonical SMILES for (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine is CCC(/C=C1/CC=C(C(C)C)N=C1C)CC.
What is the InChIKey of (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine?
The InChIKey is JXOOGLNIKULEAG-UVTDQMKNSA-N. The full InChI is InChI=1S/C15H25N/c1-6-13(7-2)10-14-8-9-15(11(3)4)16-12(14)5/h9-11,13H,6-8H2,1-5H3/b14-10-.
What are the key properties of (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine?
(3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine has a molecular weight of 219.37 g/mol, XLogP of 4.75, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-(2-ethylbutylidene)-2-methyl-6-propan-2-yl-4H-pyridine is sourced from PubChem (CID 91146280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).