1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one

C13H19N3O2 — CID 106258259

IUPAC1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one
SMILESCCCOc1cccnc1NC1CCN(C)C1=O
InChIInChI=1S/C13H19N3O2/c1-3-9-18-11-5-4-7-14-12(11)15-10-6-8-16(2)13(10)17/h4-5,7,10H,3,6,8-9H2,1-2H3,(H,14,15)
InChIKeyNJKCQMVKLSTBNS-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.51
Rot. Bonds5

About 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one

1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one (PubChem CID 106258259) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one.

Molecular Properties

Compound Name1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one
PubChem CID106258259
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one
SMILESCCCOc1cccnc1NC1CCN(C)C1=O
InChIInChI=1S/C13H19N3O2/c1-3-9-18-11-5-4-7-14-12(11)15-10-6-8-16(2)13(10)17/h4-5,7,10H,3,6,8-9H2,1-2H3,(H,14,15)
InChIKeyNJKCQMVKLSTBNS-UHFFFAOYSA-N
XLogP1.51
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]pyridine-3-carboxylate
CID 106258348
5-[(3-propoxy-2-pyridinyl)amino]piperidin-2-one
CID 113370927
N-(3-propoxy-2-pyridinyl)-3-azabicyclo[3.1.0]hexan-6-amine
CID 113371050
N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine
CID 113370946
3-[(6-ethoxy-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106258572
3-[(3-methoxy-2-pyridinyl)amino]-1-methylpiperidine-2,6-dione
CID 113370978
1-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pyrrolidin-2-one
CID 106258791
1-methyl-3-(2-propoxypyridine-3-carbonyl)pyrrolidin-2-one
CID 24773866
N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine
CID 113371376
3-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]-1-methylpyrrolidin-2-one
CID 106258631
3-amino-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]pyridine-4-carbonitrile
CID 106252122
N-[(4S)-4-methoxypyrrolidin-3-yl]-3-propoxypyridin-2-amine
CID 113371049

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one?
The IUPAC name of 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one (CID 106258259) is 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one.
What is the SMILES notation for 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one?
The canonical SMILES for 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one is CCCOc1cccnc1NC1CCN(C)C1=O.
What is the InChIKey of 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one?
The InChIKey is NJKCQMVKLSTBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-3-9-18-11-5-4-7-14-12(11)15-10-6-8-16(2)13(10)17/h4-5,7,10H,3,6,8-9H2,1-2H3,(H,14,15).
What are the key properties of 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one?
1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one has a molecular weight of 249.31 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one is sourced from PubChem (CID 106258259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).