N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide

C19H22N2O2 — CID 141121427

IUPACN-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide
SMILESO=C(NC1CCCCN1Cc1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C19H22N2O2/c22-17-11-9-16(10-12-17)19(23)20-18-8-4-5-13-21(18)14-15-6-2-1-3-7-15/h1-3,6-7,9-12,18,22H,4-5,8,13-14H2,(H,20,23)
InChIKeyPUPUCYICJULHCZ-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.13
Rot. Bonds4

About N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide

N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide (PubChem CID 141121427) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide
PubChem CID141121427
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide
SMILESO=C(NC1CCCCN1Cc1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C19H22N2O2/c22-17-11-9-16(10-12-17)19(23)20-18-8-4-5-13-21(18)14-15-6-2-1-3-7-15/h1-3,6-7,9-12,18,22H,4-5,8,13-14H2,(H,20,23)
InChIKeyPUPUCYICJULHCZ-UHFFFAOYSA-N
XLogP3.13
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
The IUPAC name of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide (CID 141121427) is N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide.
What is the SMILES notation for N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
The canonical SMILES for N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide is O=C(NC1CCCCN1Cc1ccccc1)c1ccc(O)cc1.
What is the InChIKey of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
The InChIKey is PUPUCYICJULHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-17-11-9-16(10-12-17)19(23)20-18-8-4-5-13-21(18)14-15-6-2-1-3-7-15/h1-3,6-7,9-12,18,22H,4-5,8,13-14H2,(H,20,23).
What are the key properties of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide has a molecular weight of 310.40 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide is sourced from PubChem (CID 141121427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).