N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide

C17H18N2O3 — CID 109044221

IUPACN-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide
SMILESO=C(NCc1ccco1)c1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C17H18N2O3/c20-16(18-12-15-4-3-11-22-15)13-5-7-14(8-6-13)17(21)19-9-1-2-10-19/h3-8,11H,1-2,9-10,12H2,(H,18,20)
InChIKeyCSVQGTHDVMNFCO-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.45
Rot. Bonds4

About N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide

N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide (PubChem CID 109044221) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide
PubChem CID109044221
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide
SMILESO=C(NCc1ccco1)c1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C17H18N2O3/c20-16(18-12-15-4-3-11-22-15)13-5-7-14(8-6-13)17(21)19-9-1-2-10-19/h3-8,11H,1-2,9-10,12H2,(H,18,20)
InChIKeyCSVQGTHDVMNFCO-UHFFFAOYSA-N
XLogP2.45
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide 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

N-(furan-2-ylmethyl)-4-[[2-oxo-2-[4-(piperidine-1-carbonyl)anilino]ethyl]amino]benzamide
CID 54843208
N-(furan-2-ylmethyl)-4-piperidin-1-ylbenzamide
CID 53282405
1-(furan-2-ylmethyl)-3-[4-(piperidine-1-carbonyl)phenyl]thiourea
CID 2954454
N-(furan-2-ylmethyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide
CID 53285943
N-(furan-2-ylmethyl)-3-(4-methylpiperazine-1-carbonyl)benzamide
CID 109053497
1-N-(furan-2-ylmethyl)-4-N-(4-pyrrolidin-1-ylphenyl)benzene-1,4-dicarboxamide
CID 109046634
N-(furan-2-ylmethyl)-3-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54841123
N-(furan-2-ylmethyl)-3-[[2-oxo-2-[3-(pyrrolidine-1-carbonyl)anilino]ethyl]amino]benzamide
CID 54834609
4-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 27649984
3-[(3S)-1-benzoylpiperidin-3-yl]-N-(furan-2-ylmethyl)benzamide
CID 92872465
N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 3235861
N-(furan-2-ylmethyl)-2-(pyrrolidine-1-carbonyl)-1,3-thiazole-4-carboxamide
CID 53158390

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide (CID 109044221) is N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide is O=C(NCc1ccco1)c1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide?
The InChIKey is CSVQGTHDVMNFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c20-16(18-12-15-4-3-11-22-15)13-5-7-14(8-6-13)17(21)19-9-1-2-10-19/h3-8,11H,1-2,9-10,12H2,(H,18,20).
What are the key properties of N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide?
N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide has a molecular weight of 298.34 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide is sourced from PubChem (CID 109044221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).