N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride

C12H21Cl2N3O — CID 66688370

IUPACN-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride
SMILESCNc1ccnc(OC2CCN(C)CC2)c1.Cl.Cl
InChIInChI=1S/C12H19N3O.2ClH/c1-13-10-3-6-14-12(9-10)16-11-4-7-15(2)8-5-11;;/h3,6,9,11H,4-5,7-8H2,1-2H3,(H,13,14);2*1H
InChIKeyYZHVAYLORACTEL-UHFFFAOYSA-N
MW294.23 g/mol
LogP2.44
Rot. Bonds3

About N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride

N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride (PubChem CID 66688370) has the molecular formula C12H21Cl2N3O and a molecular weight of 294.23 g/mol. Its IUPAC name is N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride.

Molecular Properties

Compound NameN-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride
PubChem CID66688370
Molecular FormulaC12H21Cl2N3O
Molecular Weight294.23 g/mol
Exact Mass293.11
IUPAC NameN-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride
SMILESCNc1ccnc(OC2CCN(C)CC2)c1.Cl.Cl
InChIInChI=1S/C12H19N3O.2ClH/c1-13-10-3-6-14-12(9-10)16-11-4-7-15(2)8-5-11;;/h3,6,9,11H,4-5,7-8H2,1-2H3,(H,13,14);2*1H
InChIKeyYZHVAYLORACTEL-UHFFFAOYSA-N
XLogP2.44
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.23
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride?
The IUPAC name of N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride (CID 66688370) is N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride.
What is the SMILES notation for N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride?
The canonical SMILES for N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride is CNc1ccnc(OC2CCN(C)CC2)c1.Cl.Cl.
What is the InChIKey of N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride?
The InChIKey is YZHVAYLORACTEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O.2ClH/c1-13-10-3-6-14-12(9-10)16-11-4-7-15(2)8-5-11;;/h3,6,9,11H,4-5,7-8H2,1-2H3,(H,13,14);2*1H.
What are the key properties of N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride?
N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride has a molecular weight of 294.23 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylpiperidin-4-yl)oxypyridin-4-amine;dihydrochloride is sourced from PubChem (CID 66688370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).