2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine

C12H19N3O — CID 106996332

IUPAC2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine
SMILESCOc1cc(NC2CCNC(C)C2)ccn1
InChIInChI=1S/C12H19N3O/c1-9-7-10(3-5-13-9)15-11-4-6-14-12(8-11)16-2/h4,6,8-10,13H,3,5,7H2,1-2H3,(H,14,15)
InChIKeyPMENWPFGVCCIBD-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.64
Rot. Bonds3

About 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine

2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine (PubChem CID 106996332) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine.

Molecular Properties

Compound Name2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine
PubChem CID106996332
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine
SMILESCOc1cc(NC2CCNC(C)C2)ccn1
InChIInChI=1S/C12H19N3O/c1-9-7-10(3-5-13-9)15-11-4-6-14-12(8-11)16-2/h4,6,8-10,13H,3,5,7H2,1-2H3,(H,14,15)
InChIKeyPMENWPFGVCCIBD-UHFFFAOYSA-N
XLogP1.64
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine?
The IUPAC name of 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine (CID 106996332) is 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine.
What is the SMILES notation for 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine?
The canonical SMILES for 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine is COc1cc(NC2CCNC(C)C2)ccn1.
What is the InChIKey of 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine?
The InChIKey is PMENWPFGVCCIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-7-10(3-5-13-9)15-11-4-6-14-12(8-11)16-2/h4,6,8-10,13H,3,5,7H2,1-2H3,(H,14,15).
What are the key properties of 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine?
2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-methylpiperidin-4-yl)pyridin-4-amine is sourced from PubChem (CID 106996332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).