N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide

C14H19N3O3 — CID 103717423

IUPACN,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide
SMILESCc1cc(=O)c(C(=O)N2CCCC2C(=O)N(C)C)c[nH]1
InChIInChI=1S/C14H19N3O3/c1-9-7-12(18)10(8-15-9)13(19)17-6-4-5-11(17)14(20)16(2)3/h7-8,11H,4-6H2,1-3H3,(H,15,18)
InChIKeyQTRSXQIBFHEHPP-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.38
Rot. Bonds2

About N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide

N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 103717423) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide
PubChem CID103717423
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC NameN,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide
SMILESCc1cc(=O)c(C(=O)N2CCCC2C(=O)N(C)C)c[nH]1
InChIInChI=1S/C14H19N3O3/c1-9-7-12(18)10(8-15-9)13(19)17-6-4-5-11(17)14(20)16(2)3/h7-8,11H,4-6H2,1-3H3,(H,15,18)
InChIKeyQTRSXQIBFHEHPP-UHFFFAOYSA-N
XLogP0.38
TPSA73.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide (CID 103717423) is N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide is Cc1cc(=O)c(C(=O)N2CCCC2C(=O)N(C)C)c[nH]1.
What is the InChIKey of N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is QTRSXQIBFHEHPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-9-7-12(18)10(8-15-9)13(19)17-6-4-5-11(17)14(20)16(2)3/h7-8,11H,4-6H2,1-3H3,(H,15,18).
What are the key properties of N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide?
N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 277.32 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 103717423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).