3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine

C11H15N — CID 123826236

IUPAC3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine
SMILESCC=CC1=NC(C)C(=CC)C=C1
InChIInChI=1S/C11H15N/c1-4-6-11-8-7-10(5-2)9(3)12-11/h4-9H,1-3H3
InChIKeyNTQGMIPHFKPVDB-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.91
Rot. Bonds1

About 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine

3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine (PubChem CID 123826236) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine.

Molecular Properties

Compound Name3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine
PubChem CID123826236
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine
SMILESCC=CC1=NC(C)C(=CC)C=C1
InChIInChI=1S/C11H15N/c1-4-6-11-8-7-10(5-2)9(3)12-11/h4-9H,1-3H3
InChIKeyNTQGMIPHFKPVDB-UHFFFAOYSA-N
XLogP2.91
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine?
The IUPAC name of 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine (CID 123826236) is 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine.
What is the SMILES notation for 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine?
The canonical SMILES for 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine is CC=CC1=NC(C)C(=CC)C=C1.
What is the InChIKey of 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine?
The InChIKey is NTQGMIPHFKPVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-4-6-11-8-7-10(5-2)9(3)12-11/h4-9H,1-3H3.
What are the key properties of 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine?
3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine has a molecular weight of 161.25 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylidene-2-methyl-6-prop-1-enyl-2H-pyridine is sourced from PubChem (CID 123826236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).