3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide

C16H18N2O3 — CID 38404476

IUPAC3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide
SMILESCNC(=O)Cc1ccc(NC(=O)CCc2ccco2)cc1
InChIInChI=1S/C16H18N2O3/c1-17-16(20)11-12-4-6-13(7-5-12)18-15(19)9-8-14-3-2-10-21-14/h2-7,10H,8-9,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyRGLUOFDQECSBEV-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.14
Rot. Bonds6

About 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide

3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide (PubChem CID 38404476) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide
PubChem CID38404476
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide
SMILESCNC(=O)Cc1ccc(NC(=O)CCc2ccco2)cc1
InChIInChI=1S/C16H18N2O3/c1-17-16(20)11-12-4-6-13(7-5-12)18-15(19)9-8-14-3-2-10-21-14/h2-7,10H,8-9,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyRGLUOFDQECSBEV-UHFFFAOYSA-N
XLogP2.14
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 60630108
dimethyl 5-[3-(furan-2-yl)propanoylamino]benzene-1,3-dicarboxylate
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2-[5-[3-(furan-2-yl)propanoylamino]-2-pyridinyl]acetic acid
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N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-3-thiophen-3-ylpropanamide
CID 35365510
[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate
CID 78763973
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CID 60690706
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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide (CID 38404476) is 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide is CNC(=O)Cc1ccc(NC(=O)CCc2ccco2)cc1.
What is the InChIKey of 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide?
The InChIKey is RGLUOFDQECSBEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-17-16(20)11-12-4-6-13(7-5-12)18-15(19)9-8-14-3-2-10-21-14/h2-7,10H,8-9,11H2,1H3,(H,17,20)(H,18,19).
What are the key properties of 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide?
3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide has a molecular weight of 286.33 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide is sourced from PubChem (CID 38404476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).