2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide

C15H19N3O3 — CID 166255026

IUPAC2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide
SMILESCC1(C)CNC(=O)C1NC(=O)c1cc(C2CC2)[nH]c(=O)c1
InChIInChI=1S/C15H19N3O3/c1-15(2)7-16-14(21)12(15)18-13(20)9-5-10(8-3-4-8)17-11(19)6-9/h5-6,8,12H,3-4,7H2,1-2H3,(H,16,21)(H,17,19)(H,18,20)
InChIKeyRSFZYOHFPCMSJN-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.51
Rot. Bonds3

About 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide

2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 166255026) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide
PubChem CID166255026
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide
SMILESCC1(C)CNC(=O)C1NC(=O)c1cc(C2CC2)[nH]c(=O)c1
InChIInChI=1S/C15H19N3O3/c1-15(2)7-16-14(21)12(15)18-13(20)9-5-10(8-3-4-8)17-11(19)6-9/h5-6,8,12H,3-4,7H2,1-2H3,(H,16,21)(H,17,19)(H,18,20)
InChIKeyRSFZYOHFPCMSJN-UHFFFAOYSA-N
XLogP0.51
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide (CID 166255026) is 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide is CC1(C)CNC(=O)C1NC(=O)c1cc(C2CC2)[nH]c(=O)c1.
What is the InChIKey of 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is RSFZYOHFPCMSJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-15(2)7-16-14(21)12(15)18-13(20)9-5-10(8-3-4-8)17-11(19)6-9/h5-6,8,12H,3-4,7H2,1-2H3,(H,16,21)(H,17,19)(H,18,20).
What are the key properties of 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide?
2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 289.33 g/mol, XLogP of 0.51, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(4,4-dimethyl-2-oxopyrrolidin-3-yl)-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 166255026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).