1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide

C18H19FN2O3 — CID 3236121

IUPAC1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCN(Cc1ccco1)C(=O)C1CCC(=O)N1Cc1ccc(F)cc1
InChIInChI=1S/C18H19FN2O3/c1-20(12-15-3-2-10-24-15)18(23)16-8-9-17(22)21(16)11-13-4-6-14(19)7-5-13/h2-7,10,16H,8-9,11-12H2,1H3
InChIKeySIFWXBIYPCXNNT-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.57
Rot. Bonds5

About 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide

1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide (PubChem CID 3236121) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
PubChem CID3236121
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCN(Cc1ccco1)C(=O)C1CCC(=O)N1Cc1ccc(F)cc1
InChIInChI=1S/C18H19FN2O3/c1-20(12-15-3-2-10-24-15)18(23)16-8-9-17(22)21(16)11-13-4-6-14(19)7-5-13/h2-7,10,16H,8-9,11-12H2,1H3
InChIKeySIFWXBIYPCXNNT-UHFFFAOYSA-N
XLogP2.57
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide 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

CID 26762
CID 26762
CID 236716
CID 236716
CID 9903743
CID 9903743
CID 11475093
CID 11475093
CID 732131
CID 732131
CID 5755140
CID 5755140
CID 5765235
CID 5765235
CID 784948
CID 784948
CID 3240475
CID 3240475
CID 738317
CID 738317
CID 1714535
CID 1714535
CID 2579466
CID 2579466

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide (CID 3236121) is 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide is CN(Cc1ccco1)C(=O)C1CCC(=O)N1Cc1ccc(F)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
The InChIKey is SIFWXBIYPCXNNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-20(12-15-3-2-10-24-15)18(23)16-8-9-17(22)21(16)11-13-4-6-14(19)7-5-13/h2-7,10,16H,8-9,11-12H2,1H3.
What are the key properties of 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide has a molecular weight of 330.36 g/mol, XLogP of 2.57, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 3236121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).