6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine

C14H23N3O — CID 63591478

IUPAC6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine
SMILESCCOc1cccc(NCC2CCN(C)CC2)n1
InChIInChI=1S/C14H23N3O/c1-3-18-14-6-4-5-13(16-14)15-11-12-7-9-17(2)10-8-12/h4-6,12H,3,7-11H2,1-2H3,(H,15,16)
InChIKeyZLYIJJXPBVLUSX-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.23
Rot. Bonds5

About 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine

6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine (PubChem CID 63591478) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine
PubChem CID63591478
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine
SMILESCCOc1cccc(NCC2CCN(C)CC2)n1
InChIInChI=1S/C14H23N3O/c1-3-18-14-6-4-5-13(16-14)15-11-12-7-9-17(2)10-8-12/h4-6,12H,3,7-11H2,1-2H3,(H,15,16)
InChIKeyZLYIJJXPBVLUSX-UHFFFAOYSA-N
XLogP2.23
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine?
The IUPAC name of 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine (CID 63591478) is 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine?
The canonical SMILES for 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine is CCOc1cccc(NCC2CCN(C)CC2)n1.
What is the InChIKey of 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine?
The InChIKey is ZLYIJJXPBVLUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-18-14-6-4-5-13(16-14)15-11-12-7-9-17(2)10-8-12/h4-6,12H,3,7-11H2,1-2H3,(H,15,16).
What are the key properties of 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine?
6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine has a molecular weight of 249.36 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 63591478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).