N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide

C15H20N2O2 — CID 143833867

IUPACN-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide
SMILESC=CCN(C(=O)c1ccccc1)C1CCN(O)CC1
InChIInChI=1S/C15H20N2O2/c1-2-10-17(14-8-11-16(19)12-9-14)15(18)13-6-4-3-5-7-13/h2-7,14,19H,1,8-12H2
InChIKeyOERWZDRQBHOLCT-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.17
Rot. Bonds4

About N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide

N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide (PubChem CID 143833867) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide.

Molecular Properties

Compound NameN-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide
PubChem CID143833867
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide
SMILESC=CCN(C(=O)c1ccccc1)C1CCN(O)CC1
InChIInChI=1S/C15H20N2O2/c1-2-10-17(14-8-11-16(19)12-9-14)15(18)13-6-4-3-5-7-13/h2-7,14,19H,1,8-12H2
InChIKeyOERWZDRQBHOLCT-UHFFFAOYSA-N
XLogP2.17
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide?
The IUPAC name of N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide (CID 143833867) is N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide.
What is the SMILES notation for N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide?
The canonical SMILES for N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide is C=CCN(C(=O)c1ccccc1)C1CCN(O)CC1.
What is the InChIKey of N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide?
The InChIKey is OERWZDRQBHOLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-2-10-17(14-8-11-16(19)12-9-14)15(18)13-6-4-3-5-7-13/h2-7,14,19H,1,8-12H2.
What are the key properties of N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide?
N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide has a molecular weight of 260.34 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypiperidin-4-yl)-N-prop-2-enylbenzamide is sourced from PubChem (CID 143833867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).