2-cyclobutyl-6-methyl-2,3-dihydropyridine

C10H15N — CID 170382022

IUPAC2-cyclobutyl-6-methyl-2,3-dihydropyridine
SMILESCC1=NC(C2CCC2)CC=C1
InChIInChI=1S/C10H15N/c1-8-4-2-7-10(11-8)9-5-3-6-9/h2,4,9-10H,3,5-7H2,1H3
InChIKeyODKINSCOXQJZSE-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.58
Rot. Bonds1

About 2-cyclobutyl-6-methyl-2,3-dihydropyridine

2-cyclobutyl-6-methyl-2,3-dihydropyridine (PubChem CID 170382022) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 2-cyclobutyl-6-methyl-2,3-dihydropyridine.

Molecular Properties

Compound Name2-cyclobutyl-6-methyl-2,3-dihydropyridine
PubChem CID170382022
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name2-cyclobutyl-6-methyl-2,3-dihydropyridine
SMILESCC1=NC(C2CCC2)CC=C1
InChIInChI=1S/C10H15N/c1-8-4-2-7-10(11-8)9-5-3-6-9/h2,4,9-10H,3,5-7H2,1H3
InChIKeyODKINSCOXQJZSE-UHFFFAOYSA-N
XLogP2.58
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-6-methyl-2,3-dihydropyridine?
The IUPAC name of 2-cyclobutyl-6-methyl-2,3-dihydropyridine (CID 170382022) is 2-cyclobutyl-6-methyl-2,3-dihydropyridine.
What is the SMILES notation for 2-cyclobutyl-6-methyl-2,3-dihydropyridine?
The canonical SMILES for 2-cyclobutyl-6-methyl-2,3-dihydropyridine is CC1=NC(C2CCC2)CC=C1.
What is the InChIKey of 2-cyclobutyl-6-methyl-2,3-dihydropyridine?
The InChIKey is ODKINSCOXQJZSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-8-4-2-7-10(11-8)9-5-3-6-9/h2,4,9-10H,3,5-7H2,1H3.
What are the key properties of 2-cyclobutyl-6-methyl-2,3-dihydropyridine?
2-cyclobutyl-6-methyl-2,3-dihydropyridine has a molecular weight of 149.24 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-6-methyl-2,3-dihydropyridine is sourced from PubChem (CID 170382022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).