4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine

C11H19N3O — CID 175051385

IUPAC4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine
SMILESCOC1=C(C2CCNCC2)CNC(N)=C1
InChIInChI=1S/C11H19N3O/c1-15-10-6-11(12)14-7-9(10)8-2-4-13-5-3-8/h6,8,13-14H,2-5,7,12H2,1H3
InChIKeyGJMKHSVHGLFWEG-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.29
Rot. Bonds2

About 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine

4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine (PubChem CID 175051385) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine.

Molecular Properties

Compound Name4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine
PubChem CID175051385
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine
SMILESCOC1=C(C2CCNCC2)CNC(N)=C1
InChIInChI=1S/C11H19N3O/c1-15-10-6-11(12)14-7-9(10)8-2-4-13-5-3-8/h6,8,13-14H,2-5,7,12H2,1H3
InChIKeyGJMKHSVHGLFWEG-UHFFFAOYSA-N
XLogP0.29
TPSA59.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine?
The IUPAC name of 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine (CID 175051385) is 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine.
What is the SMILES notation for 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine?
The canonical SMILES for 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine is COC1=C(C2CCNCC2)CNC(N)=C1.
What is the InChIKey of 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine?
The InChIKey is GJMKHSVHGLFWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-15-10-6-11(12)14-7-9(10)8-2-4-13-5-3-8/h6,8,13-14H,2-5,7,12H2,1H3.
What are the key properties of 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine?
4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine has a molecular weight of 209.29 g/mol, XLogP of 0.29, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-piperidin-4-yl-1,2-dihydropyridin-6-amine is sourced from PubChem (CID 175051385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).