N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide

C20H25N3O2 — CID 175451125

IUPACN,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide
SMILESCN(C)C(=O)c1ccc(COc2cccc(C3CCNCC3)n2)cc1
InChIInChI=1S/C20H25N3O2/c1-23(2)20(24)17-8-6-15(7-9-17)14-25-19-5-3-4-18(22-19)16-10-12-21-13-11-16/h3-9,16,21H,10-14H2,1-2H3
InChIKeyXYFYQXCBUAGTPG-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.83
Rot. Bonds5

About N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide

N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide (PubChem CID 175451125) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide
PubChem CID175451125
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide
SMILESCN(C)C(=O)c1ccc(COc2cccc(C3CCNCC3)n2)cc1
InChIInChI=1S/C20H25N3O2/c1-23(2)20(24)17-8-6-15(7-9-17)14-25-19-5-3-4-18(22-19)16-10-12-21-13-11-16/h3-9,16,21H,10-14H2,1-2H3
InChIKeyXYFYQXCBUAGTPG-UHFFFAOYSA-N
XLogP2.83
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide?
The IUPAC name of N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide (CID 175451125) is N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide is CN(C)C(=O)c1ccc(COc2cccc(C3CCNCC3)n2)cc1.
What is the InChIKey of N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide?
The InChIKey is XYFYQXCBUAGTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-23(2)20(24)17-8-6-15(7-9-17)14-25-19-5-3-4-18(22-19)16-10-12-21-13-11-16/h3-9,16,21H,10-14H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide?
N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide has a molecular weight of 339.44 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide is sourced from PubChem (CID 175451125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).