3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide

C16H23N3O2 — CID 3244897

IUPAC3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide
SMILESCN(C)C(=O)N1CCCC(C(=O)NCc2ccccc2)C1
InChIInChI=1S/C16H23N3O2/c1-18(2)16(21)19-10-6-9-14(12-19)15(20)17-11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3,(H,17,20)
InChIKeySLTGFUYXDXBXDR-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.70
Rot. Bonds3

About 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide

3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide (PubChem CID 3244897) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide
PubChem CID3244897
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide
SMILESCN(C)C(=O)N1CCCC(C(=O)NCc2ccccc2)C1
InChIInChI=1S/C16H23N3O2/c1-18(2)16(21)19-10-6-9-14(12-19)15(20)17-11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3,(H,17,20)
InChIKeySLTGFUYXDXBXDR-UHFFFAOYSA-N
XLogP1.70
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide (CID 3244897) is 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide is CN(C)C(=O)N1CCCC(C(=O)NCc2ccccc2)C1.
What is the InChIKey of 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide?
The InChIKey is SLTGFUYXDXBXDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-18(2)16(21)19-10-6-9-14(12-19)15(20)17-11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3,(H,17,20).
What are the key properties of 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide?
3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-benzyl-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide is sourced from PubChem (CID 3244897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).