4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine

C11H21N3O — CID 134577898

IUPAC4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine
SMILESCN1CCC(OC2=C(N)CNCC2)CC1
InChIInChI=1S/C11H21N3O/c1-14-6-3-9(4-7-14)15-11-2-5-13-8-10(11)12/h9,13H,2-8,12H2,1H3
InChIKeyBVVAVNPIRONIGK-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.26
Rot. Bonds2

About 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine

4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine (PubChem CID 134577898) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine.

Molecular Properties

Compound Name4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine
PubChem CID134577898
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine
SMILESCN1CCC(OC2=C(N)CNCC2)CC1
InChIInChI=1S/C11H21N3O/c1-14-6-3-9(4-7-14)15-11-2-5-13-8-10(11)12/h9,13H,2-8,12H2,1H3
InChIKeyBVVAVNPIRONIGK-UHFFFAOYSA-N
XLogP0.26
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine?
The IUPAC name of 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine (CID 134577898) is 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine.
What is the SMILES notation for 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine?
The canonical SMILES for 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine is CN1CCC(OC2=C(N)CNCC2)CC1.
What is the InChIKey of 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine?
The InChIKey is BVVAVNPIRONIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-14-6-3-9(4-7-14)15-11-2-5-13-8-10(11)12/h9,13H,2-8,12H2,1H3.
What are the key properties of 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine?
4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine has a molecular weight of 211.31 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-5-amine is sourced from PubChem (CID 134577898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).