1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one

C19H25N3O3 — CID 97026177

IUPAC1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
SMILESCC[C@@H]1CN(C(=O)c2ccc(Cn3ccccc3=O)o2)C[C@@H]1N(C)C
InChIInChI=1S/C19H25N3O3/c1-4-14-11-22(13-16(14)20(2)3)19(24)17-9-8-15(25-17)12-21-10-6-5-7-18(21)23/h5-10,14,16H,4,11-13H2,1-3H3/t14-,16+/m1/s1
InChIKeyNSOWDLVAVIQYBX-ZBFHGGJFSA-N
MW343.43 g/mol
LogP1.90
Rot. Bonds5

About 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one

1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one (PubChem CID 97026177) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one.

Molecular Properties

Compound Name1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
PubChem CID97026177
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
SMILESCC[C@@H]1CN(C(=O)c2ccc(Cn3ccccc3=O)o2)C[C@@H]1N(C)C
InChIInChI=1S/C19H25N3O3/c1-4-14-11-22(13-16(14)20(2)3)19(24)17-9-8-15(25-17)12-21-10-6-5-7-18(21)23/h5-10,14,16H,4,11-13H2,1-3H3/t14-,16+/m1/s1
InChIKeyNSOWDLVAVIQYBX-ZBFHGGJFSA-N
XLogP1.90
TPSA58.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-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

1-[[5-[(3S,4R)-3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 96513043
1-[[5-[(3S,5S)-3,5-dimethylpiperazine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 124589659
1-[5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbonyl]piperidine-4-carboxamide
CID 71899552
(3S)-1-[5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbonyl]piperidine-3-carboxylic acid
CID 124703095
1-[[5-[(2S,5R)-2-ethyl-5-methylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 97256064
[(3S,4R)-3-(dimethylamino)-4-propylpyrrolidin-1-yl]-[5-(hydroxymethyl)furan-2-yl]methanone
CID 133138412
1-[[5-[4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 134024817
N-cyclopropyl-2-[4-[5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbonyl]piperazin-1-yl]acetamide
CID 134024734
1-[[5-(4-pyridin-2-ylpiperazine-1-carbonyl)furan-2-yl]methyl]pyridin-2-one
CID 134024324
1-[[5-[(4aR,8aS)-1-benzyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 97082289
1-[[5-[(4aR,8aR)-1-benzyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 98793331
N-(2-hydroxyethyl)-5-[(2-oxo-1-pyridinyl)methyl]-N-propylfuran-2-carboxamide
CID 110887129

Frequently Asked Questions

What is the IUPAC name of 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one?
The IUPAC name of 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one (CID 97026177) is 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one.
What is the SMILES notation for 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one?
The canonical SMILES for 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one is CC[C@@H]1CN(C(=O)c2ccc(Cn3ccccc3=O)o2)C[C@@H]1N(C)C.
What is the InChIKey of 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one?
The InChIKey is NSOWDLVAVIQYBX-ZBFHGGJFSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-4-14-11-22(13-16(14)20(2)3)19(24)17-9-8-15(25-17)12-21-10-6-5-7-18(21)23/h5-10,14,16H,4,11-13H2,1-3H3/t14-,16+/m1/s1.
What are the key properties of 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one?
1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one has a molecular weight of 343.43 g/mol, XLogP of 1.90, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-[(3R,4R)-3-(dimethylamino)-4-ethylpyrrolidine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one is sourced from PubChem (CID 97026177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).