N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine

C12H19N3O — CID 45097725

IUPACN-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine
SMILESCNc1cccc(OC2CCN(C)CC2)n1
InChIInChI=1S/C12H19N3O/c1-13-11-4-3-5-12(14-11)16-10-6-8-15(2)9-7-10/h3-5,10H,6-9H2,1-2H3,(H,13,14)
InChIKeyNPBXSMXLVPYBLX-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.60
Rot. Bonds3

About N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine

N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine (PubChem CID 45097725) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine
PubChem CID45097725
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine
SMILESCNc1cccc(OC2CCN(C)CC2)n1
InChIInChI=1S/C12H19N3O/c1-13-11-4-3-5-12(14-11)16-10-6-8-15(2)9-7-10/h3-5,10H,6-9H2,1-2H3,(H,13,14)
InChIKeyNPBXSMXLVPYBLX-UHFFFAOYSA-N
XLogP1.60
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine?
The IUPAC name of N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine (CID 45097725) is N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine.
What is the SMILES notation for N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine?
The canonical SMILES for N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine is CNc1cccc(OC2CCN(C)CC2)n1.
What is the InChIKey of N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine?
The InChIKey is NPBXSMXLVPYBLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-13-11-4-3-5-12(14-11)16-10-6-8-15(2)9-7-10/h3-5,10H,6-9H2,1-2H3,(H,13,14).
What are the key properties of N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine?
N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine has a molecular weight of 221.30 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine is sourced from PubChem (CID 45097725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).