6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine

C13H21N3O — CID 107390510

IUPAC6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine
SMILESCOC1(C)CCCN(c2cc(C)c(N)cn2)C1
InChIInChI=1S/C13H21N3O/c1-10-7-12(15-8-11(10)14)16-6-4-5-13(2,9-16)17-3/h7-8H,4-6,9,14H2,1-3H3
InChIKeyYHIMGMPECMAXJO-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.98
Rot. Bonds2

About 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine

6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine (PubChem CID 107390510) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine
PubChem CID107390510
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine
SMILESCOC1(C)CCCN(c2cc(C)c(N)cn2)C1
InChIInChI=1S/C13H21N3O/c1-10-7-12(15-8-11(10)14)16-6-4-5-13(2,9-16)17-3/h7-8H,4-6,9,14H2,1-3H3
InChIKeyYHIMGMPECMAXJO-UHFFFAOYSA-N
XLogP1.98
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine?
The IUPAC name of 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine (CID 107390510) is 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine.
What is the SMILES notation for 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine?
The canonical SMILES for 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine is COC1(C)CCCN(c2cc(C)c(N)cn2)C1.
What is the InChIKey of 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine?
The InChIKey is YHIMGMPECMAXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10-7-12(15-8-11(10)14)16-6-4-5-13(2,9-16)17-3/h7-8H,4-6,9,14H2,1-3H3.
What are the key properties of 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine?
6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine has a molecular weight of 235.33 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpyridin-3-amine is sourced from PubChem (CID 107390510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).