N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide

C13H19N3O — CID 113357303

IUPACN-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide
SMILESCc1cc(C)nc(NC(=O)C2CNCC2C)c1
InChIInChI=1S/C13H19N3O/c1-8-4-10(3)15-12(5-8)16-13(17)11-7-14-6-9(11)2/h4-5,9,11,14H,6-7H2,1-3H3,(H,15,16,17)
InChIKeyVYCDZLIFPQBIHR-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.49
Rot. Bonds2

About N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide

N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide (PubChem CID 113357303) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide
PubChem CID113357303
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide
SMILESCc1cc(C)nc(NC(=O)C2CNCC2C)c1
InChIInChI=1S/C13H19N3O/c1-8-4-10(3)15-12(5-8)16-13(17)11-7-14-6-9(11)2/h4-5,9,11,14H,6-7H2,1-3H3,(H,15,16,17)
InChIKeyVYCDZLIFPQBIHR-UHFFFAOYSA-N
XLogP1.49
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,6-dimethyl-2-pyridinyl)piperidine-4-carboxamide
CID 115976769
N-(5-bromo-6-methyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide
CID 79049026
2-amino-N-(4,6-dimethyl-2-pyridinyl)cycloheptane-1-carboxamide
CID 114932391
(1R,2R,4R)-N-(4,6-dimethyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 98278427
(1R,2S,4R)-N-(4,6-dimethyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 98278428
N-(4,6-dimethyl-2-pyridinyl)pyrazolidine-3-carboxamide
CID 123941964
(3S,4S)-N-(5-bromo-2-methylphenyl)-4-methylpyrrolidine-3-carboxamide
CID 98538433
N-(4,5-dimethoxy-2-methylphenyl)-4-methylpyrrolidine-3-carboxamide
CID 63714118
(3S)-N-(4,6-dimethyl-2-pyridinyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 104985001
(3R)-N-(4,6-dimethyl-2-pyridinyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 104985000
(2S)-N-(4,6-dimethyl-2-pyridinyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 104985011
N-(4-ethyl-3-methylphenyl)-4-methylpyrrolidine-3-carboxamide
CID 113357371

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide (CID 113357303) is N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide is Cc1cc(C)nc(NC(=O)C2CNCC2C)c1.
What is the InChIKey of N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide?
The InChIKey is VYCDZLIFPQBIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-8-4-10(3)15-12(5-8)16-13(17)11-7-14-6-9(11)2/h4-5,9,11,14H,6-7H2,1-3H3,(H,15,16,17).
What are the key properties of N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide?
N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethyl-2-pyridinyl)-4-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 113357303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).