N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide

C14H21N3O2 — CID 155455788

IUPACN-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide
SMILESCc1cc(=O)cc(C(=O)NC2(C)CCN(C)CC2)[nH]1
InChIInChI=1S/C14H21N3O2/c1-10-8-11(18)9-12(15-10)13(19)16-14(2)4-6-17(3)7-5-14/h8-9H,4-7H2,1-3H3,(H,15,18)(H,16,19)
InChIKeyOXPLUTXVQZNWIP-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.90
Rot. Bonds2

About N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide

N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide (PubChem CID 155455788) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide
PubChem CID155455788
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide
SMILESCc1cc(=O)cc(C(=O)NC2(C)CCN(C)CC2)[nH]1
InChIInChI=1S/C14H21N3O2/c1-10-8-11(18)9-12(15-10)13(19)16-14(2)4-6-17(3)7-5-14/h8-9H,4-7H2,1-3H3,(H,15,18)(H,16,19)
InChIKeyOXPLUTXVQZNWIP-UHFFFAOYSA-N
XLogP0.90
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide (CID 155455788) is N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide is Cc1cc(=O)cc(C(=O)NC2(C)CCN(C)CC2)[nH]1.
What is the InChIKey of N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide?
The InChIKey is OXPLUTXVQZNWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10-8-11(18)9-12(15-10)13(19)16-14(2)4-6-17(3)7-5-14/h8-9H,4-7H2,1-3H3,(H,15,18)(H,16,19).
What are the key properties of N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide?
N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dimethylpiperidin-4-yl)-6-methyl-4-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 155455788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).