1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine

C13H22N2O2 — CID 82893718

IUPAC1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine
SMILESCCC(C)(N)COCc1cc(OC)cc(C)n1
InChIInChI=1S/C13H22N2O2/c1-5-13(3,14)9-17-8-11-7-12(16-4)6-10(2)15-11/h6-7H,5,8-9,14H2,1-4H3
InChIKeyLWUHLXFETAEUCA-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.04
Rot. Bonds6

About 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine

1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine (PubChem CID 82893718) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine.

Molecular Properties

Compound Name1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine
PubChem CID82893718
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine
SMILESCCC(C)(N)COCc1cc(OC)cc(C)n1
InChIInChI=1S/C13H22N2O2/c1-5-13(3,14)9-17-8-11-7-12(16-4)6-10(2)15-11/h6-7H,5,8-9,14H2,1-4H3
InChIKeyLWUHLXFETAEUCA-UHFFFAOYSA-N
XLogP2.04
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine?
The IUPAC name of 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine (CID 82893718) is 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine.
What is the SMILES notation for 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine?
The canonical SMILES for 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine is CCC(C)(N)COCc1cc(OC)cc(C)n1.
What is the InChIKey of 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine?
The InChIKey is LWUHLXFETAEUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-5-13(3,14)9-17-8-11-7-12(16-4)6-10(2)15-11/h6-7H,5,8-9,14H2,1-4H3.
What are the key properties of 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine?
1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine has a molecular weight of 238.33 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-2-methylbutan-2-amine is sourced from PubChem (CID 82893718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).