N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide

C16H16N2O3 — CID 3235861

IUPACN-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESO=C(NCc1ccco1)c1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C16H16N2O3/c19-15-4-1-9-18(15)13-7-5-12(6-8-13)16(20)17-11-14-3-2-10-21-14/h2-3,5-8,10H,1,4,9,11H2,(H,17,20)
InChIKeyYNPHQIYPHCUIEJ-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.34
Rot. Bonds4

About N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide

N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 3235861) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID3235861
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC NameN-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESO=C(NCc1ccco1)c1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C16H16N2O3/c19-15-4-1-9-18(15)13-7-5-12(6-8-13)16(20)17-11-14-3-2-10-21-14/h2-3,5-8,10H,1,4,9,11H2,(H,17,20)
InChIKeyYNPHQIYPHCUIEJ-UHFFFAOYSA-N
XLogP2.34
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 4-(2-oxopyrrolidin-1-yl)benzoate
CID 42902540
4-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589075
N-(furan-2-ylmethyl)-4-piperidin-1-ylbenzamide
CID 53282405
4-(2-oxopyrrolidin-1-yl)-N-(thiophen-2-ylmethyl)benzamide
CID 2439556
N-(2-benzamidoethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24659936
4-(2-oxopyrrolidin-1-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 39003599
N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044221
1-ethyl-3-(furan-2-ylmethyl)-2-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]guanidine
CID 110938384
N-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]phenyl]furan-2-carboxamide
CID 9371428
1-N-(furan-2-ylmethyl)-4-N-(4-pyrrolidin-1-ylphenyl)benzene-1,4-dicarboxamide
CID 109046634
4-[(2R)-3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 92684153
N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 94134184

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide (CID 3235861) is N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide is O=C(NCc1ccco1)c1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is YNPHQIYPHCUIEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c19-15-4-1-9-18(15)13-7-5-12(6-8-13)16(20)17-11-14-3-2-10-21-14/h2-3,5-8,10H,1,4,9,11H2,(H,17,20).
What are the key properties of N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
N-(furan-2-ylmethyl)-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 284.31 g/mol, XLogP of 2.34, 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-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 3235861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).