3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide

C23H24N2O3 — CID 113118141

IUPAC3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide
SMILESCC(=O)N(CCC(=O)N(Cc1ccccc1)c1ccccc1)Cc1ccco1
InChIInChI=1S/C23H24N2O3/c1-19(26)24(18-22-13-8-16-28-22)15-14-23(27)25(21-11-6-3-7-12-21)17-20-9-4-2-5-10-20/h2-13,16H,14-15,17-18H2,1H3
InChIKeyCCOMZZCHEKRKOU-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.25
Rot. Bonds8

About 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide

3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide (PubChem CID 113118141) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide.

Molecular Properties

Compound Name3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide
PubChem CID113118141
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide
SMILESCC(=O)N(CCC(=O)N(Cc1ccccc1)c1ccccc1)Cc1ccco1
InChIInChI=1S/C23H24N2O3/c1-19(26)24(18-22-13-8-16-28-22)15-14-23(27)25(21-11-6-3-7-12-21)17-20-9-4-2-5-10-20/h2-13,16H,14-15,17-18H2,1H3
InChIKeyCCOMZZCHEKRKOU-UHFFFAOYSA-N
XLogP4.25
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[acetyl-[2-(dimethylamino)ethyl]amino]-N-benzyl-N-phenylpropanamide
CID 113117602
N-benzyl-2-[cyclopropyl(furan-2-ylmethyl)amino]-N-phenylacetamide
CID 34218809
N-(furan-2-ylmethyl)-2-[methyl(3-methylbutyl)amino]-N-phenylacetamide
CID 78899393
2-[acetyl(cyclopropyl)amino]-N-benzyl-N-(furan-2-ylmethyl)acetamide
CID 4281415
3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide
CID 113118209
3-[acetyl(benzyl)amino]-N,N-diethylpropanamide
CID 113118249
N-benzyl-N-(furan-2-ylmethyl)-2-(methylamino)acetamide;hydrochloride
CID 120703561
N-benzyl-2-ethoxy-N-(furan-2-ylmethyl)acetamide
CID 52556901
3-[furan-2-ylmethyl(pentanoyl)amino]propanoic acid
CID 82323491
3-[acetyl(3-phenylpropyl)amino]-N-(furan-2-ylmethyl)propanamide
CID 113122215
2-[acetyl-[(2S)-butan-2-yl]amino]-N-(furan-2-ylmethyl)-N-(2-phenylethyl)acetamide
CID 7416543
N-[2-[acetyl(benzyl)amino]ethyl]-N-benzylacetamide
CID 562449

Frequently Asked Questions

What is the IUPAC name of 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide?
The IUPAC name of 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide (CID 113118141) is 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide.
What is the SMILES notation for 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide?
The canonical SMILES for 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide is CC(=O)N(CCC(=O)N(Cc1ccccc1)c1ccccc1)Cc1ccco1.
What is the InChIKey of 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide?
The InChIKey is CCOMZZCHEKRKOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-19(26)24(18-22-13-8-16-28-22)15-14-23(27)25(21-11-6-3-7-12-21)17-20-9-4-2-5-10-20/h2-13,16H,14-15,17-18H2,1H3.
What are the key properties of 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide?
3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide has a molecular weight of 376.46 g/mol, XLogP of 4.25, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide is sourced from PubChem (CID 113118141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).