[2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine

C14H22N2O — CID 106199510

IUPAC[2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine
SMILESCc1cc(C)c(CN)c(OCCC2CCC2)n1
InChIInChI=1S/C14H22N2O/c1-10-8-11(2)16-14(13(10)9-15)17-7-6-12-4-3-5-12/h8,12H,3-7,9,15H2,1-2H3
InChIKeyAVCWZNAPEUVGOY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.73
Rot. Bonds5

About [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine

[2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine (PubChem CID 106199510) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine
PubChem CID106199510
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine
SMILESCc1cc(C)c(CN)c(OCCC2CCC2)n1
InChIInChI=1S/C14H22N2O/c1-10-8-11(2)16-14(13(10)9-15)17-7-6-12-4-3-5-12/h8,12H,3-7,9,15H2,1-2H3
InChIKeyAVCWZNAPEUVGOY-UHFFFAOYSA-N
XLogP2.73
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The IUPAC name of [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine (CID 106199510) is [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The canonical SMILES for [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine is Cc1cc(C)c(CN)c(OCCC2CCC2)n1.
What is the InChIKey of [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The InChIKey is AVCWZNAPEUVGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10-8-11(2)16-14(13(10)9-15)17-7-6-12-4-3-5-12/h8,12H,3-7,9,15H2,1-2H3.
What are the key properties of [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
[2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine has a molecular weight of 234.34 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-cyclobutylethoxy)-4,6-dimethyl-3-pyridinyl]methanamine is sourced from PubChem (CID 106199510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).