5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine

C15H25N3O — CID 62183322

IUPAC5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(CN2CCC(OCC)CC2)cn1
InChIInChI=1S/C15H25N3O/c1-3-16-15-6-5-13(11-17-15)12-18-9-7-14(8-10-18)19-4-2/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,16,17)
InChIKeyMTMMCAGRRYHMOV-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.51
Rot. Bonds6

About 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine

5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine (PubChem CID 62183322) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine
PubChem CID62183322
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(CN2CCC(OCC)CC2)cn1
InChIInChI=1S/C15H25N3O/c1-3-16-15-6-5-13(11-17-15)12-18-9-7-14(8-10-18)19-4-2/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,16,17)
InChIKeyMTMMCAGRRYHMOV-UHFFFAOYSA-N
XLogP2.51
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine (CID 62183322) is 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine is CCNc1ccc(CN2CCC(OCC)CC2)cn1.
What is the InChIKey of 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine?
The InChIKey is MTMMCAGRRYHMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-3-16-15-6-5-13(11-17-15)12-18-9-7-14(8-10-18)19-4-2/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,16,17).
What are the key properties of 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine?
5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine has a molecular weight of 263.38 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-ethoxypiperidin-1-yl)methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 62183322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).