6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine

C13H21N3O — CID 114695582

IUPAC6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine
SMILESCCOc1cccc(NC2CCCNC2C)n1
InChIInChI=1S/C13H21N3O/c1-3-17-13-8-4-7-12(16-13)15-11-6-5-9-14-10(11)2/h4,7-8,10-11,14H,3,5-6,9H2,1-2H3,(H,15,16)
InChIKeyQYUXUDRXQOKWOV-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.03
Rot. Bonds4

About 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine

6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine (PubChem CID 114695582) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine
PubChem CID114695582
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine
SMILESCCOc1cccc(NC2CCCNC2C)n1
InChIInChI=1S/C13H21N3O/c1-3-17-13-8-4-7-12(16-13)15-11-6-5-9-14-10(11)2/h4,7-8,10-11,14H,3,5-6,9H2,1-2H3,(H,15,16)
InChIKeyQYUXUDRXQOKWOV-UHFFFAOYSA-N
XLogP2.03
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine?
The IUPAC name of 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine (CID 114695582) is 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine.
What is the SMILES notation for 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine?
The canonical SMILES for 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine is CCOc1cccc(NC2CCCNC2C)n1.
What is the InChIKey of 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine?
The InChIKey is QYUXUDRXQOKWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-17-13-8-4-7-12(16-13)15-11-6-5-9-14-10(11)2/h4,7-8,10-11,14H,3,5-6,9H2,1-2H3,(H,15,16).
What are the key properties of 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine?
6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(2-methylpiperidin-3-yl)pyridin-2-amine is sourced from PubChem (CID 114695582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).