N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide

C17H18N2O3 — CID 9360830

IUPACN-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide
SMILESO=C(CCc1ccco1)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C17H18N2O3/c20-16(9-8-15-5-2-10-22-15)18-14-4-1-3-12(11-14)17(21)19-13-6-7-13/h1-5,10-11,13H,6-9H2,(H,18,20)(H,19,21)
InChIKeyORJPOUPONHNOGA-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.74
Rot. Bonds6

About N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide

N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide (PubChem CID 9360830) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide
PubChem CID9360830
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide
SMILESO=C(CCc1ccco1)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C17H18N2O3/c20-16(9-8-15-5-2-10-22-15)18-14-4-1-3-12(11-14)17(21)19-13-6-7-13/h1-5,10-11,13H,6-9H2,(H,18,20)(H,19,21)
InChIKeyORJPOUPONHNOGA-UHFFFAOYSA-N
XLogP2.74
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-[cyclopentyl(furan-2-ylmethyl)amino]acetyl]amino]-N-cyclopropylbenzamide
CID 47056867
N-cyclopropyl-3-[3-(4-methylphenyl)propanoylamino]benzamide
CID 18121849
N-cyclopropyl-3-(5-hydroxypentanoylamino)benzamide
CID 79199370
N-cyclopropyl-3-[[2-[furan-2-ylmethyl(oxolan-2-ylmethyl)amino]acetyl]amino]benzamide
CID 47537148
3-[3-(2-aminophenyl)propanoylamino]-N-cyclohexylbenzamide
CID 54795525
N-cyclohexyl-3-[[2-[3-(furan-2-ylmethylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54831065
3-[3-(4-tert-butylphenyl)propanoylamino]-N-cyclopropylbenzamide
CID 46698713
N,N'-bis[3-(cyclohexylcarbamoyl)phenyl]decanediamide
CID 17170648
3-[(2-cyanoacetyl)amino]-N-cyclopropylbenzamide
CID 168520744
3-(furan-2-yl)-N-[3-(hydroxymethyl)phenyl]propanamide
CID 60630108
N-[3-(cyclopropylcarbamoyl)phenyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 51241967
N-cyclohexyl-3-[[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]benzamide
CID 54831186

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide?
The IUPAC name of N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide (CID 9360830) is N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide.
What is the SMILES notation for N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide?
The canonical SMILES for N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide is O=C(CCc1ccco1)Nc1cccc(C(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide?
The InChIKey is ORJPOUPONHNOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c20-16(9-8-15-5-2-10-22-15)18-14-4-1-3-12(11-14)17(21)19-13-6-7-13/h1-5,10-11,13H,6-9H2,(H,18,20)(H,19,21).
What are the key properties of N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide?
N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide has a molecular weight of 298.34 g/mol, XLogP of 2.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[3-(furan-2-yl)propanoylamino]benzamide is sourced from PubChem (CID 9360830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).