6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one

C13H19N3O2 — CID 107261752

IUPAC6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCN(C)C1CCN(C(=O)c2cccc(=O)[nH]2)CC1
InChIInChI=1S/C13H19N3O2/c1-15(2)10-6-8-16(9-7-10)13(18)11-4-3-5-12(17)14-11/h3-5,10H,6-9H2,1-2H3,(H,14,17)
InChIKeyDSNBPAMFGPHZRM-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.54
Rot. Bonds2

About 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one

6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 107261752) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID107261752
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCN(C)C1CCN(C(=O)c2cccc(=O)[nH]2)CC1
InChIInChI=1S/C13H19N3O2/c1-15(2)10-6-8-16(9-7-10)13(18)11-4-3-5-12(17)14-11/h3-5,10H,6-9H2,1-2H3,(H,14,17)
InChIKeyDSNBPAMFGPHZRM-UHFFFAOYSA-N
XLogP0.54
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one (CID 107261752) is 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one is CN(C)C1CCN(C(=O)c2cccc(=O)[nH]2)CC1.
What is the InChIKey of 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is DSNBPAMFGPHZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-15(2)10-6-8-16(9-7-10)13(18)11-4-3-5-12(17)14-11/h3-5,10H,6-9H2,1-2H3,(H,14,17).
What are the key properties of 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one?
6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 249.31 g/mol, XLogP of 0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 107261752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).