2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide

C20H25N3O2 — CID 56712951

IUPAC2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide
SMILESO=C(NCCC1CCCN(Cc2cccnc2)C1)c1ccccc1O
InChIInChI=1S/C20H25N3O2/c24-19-8-2-1-7-18(19)20(25)22-11-9-16-6-4-12-23(14-16)15-17-5-3-10-21-13-17/h1-3,5,7-8,10,13,16,24H,4,6,9,11-12,14-15H2,(H,22,25)
InChIKeyOIIQSPASHJNYBU-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.82
Rot. Bonds6

About 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide

2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide (PubChem CID 56712951) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide
PubChem CID56712951
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide
SMILESO=C(NCCC1CCCN(Cc2cccnc2)C1)c1ccccc1O
InChIInChI=1S/C20H25N3O2/c24-19-8-2-1-7-18(19)20(25)22-11-9-16-6-4-12-23(14-16)15-17-5-3-10-21-13-17/h1-3,5,7-8,10,13,16,24H,4,6,9,11-12,14-15H2,(H,22,25)
InChIKeyOIIQSPASHJNYBU-UHFFFAOYSA-N
XLogP2.82
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide?
The IUPAC name of 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide (CID 56712951) is 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide.
What is the SMILES notation for 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide?
The canonical SMILES for 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide is O=C(NCCC1CCCN(Cc2cccnc2)C1)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide?
The InChIKey is OIIQSPASHJNYBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c24-19-8-2-1-7-18(19)20(25)22-11-9-16-6-4-12-23(14-16)15-17-5-3-10-21-13-17/h1-3,5,7-8,10,13,16,24H,4,6,9,11-12,14-15H2,(H,22,25).
What are the key properties of 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide?
2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide has a molecular weight of 339.44 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethyl]benzamide is sourced from PubChem (CID 56712951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).