3-methoxy-N-piperidin-4-ylbenzamide

C13H18N2O2 — CID 1445157

IUPAC3-methoxy-N-piperidin-4-ylbenzamide
SMILESCOc1cccc(C(=O)NC2CCNCC2)c1
InChIInChI=1S/C13H18N2O2/c1-17-12-4-2-3-10(9-12)13(16)15-11-5-7-14-8-6-11/h2-4,9,11,14H,5-8H2,1H3,(H,15,16)
InChIKeyRVNIFQHYLAWJDT-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.18
Rot. Bonds3

About 3-methoxy-N-piperidin-4-ylbenzamide

3-methoxy-N-piperidin-4-ylbenzamide (PubChem CID 1445157) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 3-methoxy-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound Name3-methoxy-N-piperidin-4-ylbenzamide
PubChem CID1445157
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name3-methoxy-N-piperidin-4-ylbenzamide
SMILESCOc1cccc(C(=O)NC2CCNCC2)c1
InChIInChI=1S/C13H18N2O2/c1-17-12-4-2-3-10(9-12)13(16)15-11-5-7-14-8-6-11/h2-4,9,11,14H,5-8H2,1H3,(H,15,16)
InChIKeyRVNIFQHYLAWJDT-UHFFFAOYSA-N
XLogP1.18
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-piperidin-4-ylbenzamide?
The IUPAC name of 3-methoxy-N-piperidin-4-ylbenzamide (CID 1445157) is 3-methoxy-N-piperidin-4-ylbenzamide.
What is the SMILES notation for 3-methoxy-N-piperidin-4-ylbenzamide?
The canonical SMILES for 3-methoxy-N-piperidin-4-ylbenzamide is COc1cccc(C(=O)NC2CCNCC2)c1.
What is the InChIKey of 3-methoxy-N-piperidin-4-ylbenzamide?
The InChIKey is RVNIFQHYLAWJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-17-12-4-2-3-10(9-12)13(16)15-11-5-7-14-8-6-11/h2-4,9,11,14H,5-8H2,1H3,(H,15,16).
What are the key properties of 3-methoxy-N-piperidin-4-ylbenzamide?
3-methoxy-N-piperidin-4-ylbenzamide has a molecular weight of 234.30 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 1445157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).