2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide

C22H24N2O2 — CID 8696124

IUPAC2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide
SMILESO=C(CN[C@H](c1ccccc1)c1ccco1)NCCCc1ccccc1
InChIInChI=1S/C22H24N2O2/c25-21(23-15-7-11-18-9-3-1-4-10-18)17-24-22(20-14-8-16-26-20)19-12-5-2-6-13-19/h1-6,8-10,12-14,16,22,24H,7,11,15,17H2,(H,23,25)/t22-/m1/s1
InChIKeyXROJBSNTDIUHRO-JOCHJYFZSA-N
MW348.45 g/mol
LogP3.71
Rot. Bonds9

About 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide

2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide (PubChem CID 8696124) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide
PubChem CID8696124
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide
SMILESO=C(CN[C@H](c1ccccc1)c1ccco1)NCCCc1ccccc1
InChIInChI=1S/C22H24N2O2/c25-21(23-15-7-11-18-9-3-1-4-10-18)17-24-22(20-14-8-16-26-20)19-12-5-2-6-13-19/h1-6,8-10,12-14,16,22,24H,7,11,15,17H2,(H,23,25)/t22-/m1/s1
InChIKeyXROJBSNTDIUHRO-JOCHJYFZSA-N
XLogP3.71
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-2-[[(S)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8756176
N-[2-(3-chlorophenyl)ethyl]-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8756406
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-(3-methylbutyl)acetamide
CID 8755034
N-(butylcarbamoyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8756602
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 8756444
N-[2-oxo-2-(3-phenylpropylamino)ethyl]furan-2-carboxamide
CID 2524355
N-(2-benzylphenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8755114
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)acetamide
CID 8755288
N-(2,6-dichlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8696128
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(2-methylpropylcarbamoyl)acetamide
CID 8755412
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 8756496
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(2-phenylphenyl)acetamide
CID 8755106

Frequently Asked Questions

What is the IUPAC name of 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide?
The IUPAC name of 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide (CID 8696124) is 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide.
What is the SMILES notation for 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide?
The canonical SMILES for 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide is O=C(CN[C@H](c1ccccc1)c1ccco1)NCCCc1ccccc1.
What is the InChIKey of 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide?
The InChIKey is XROJBSNTDIUHRO-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H24N2O2/c25-21(23-15-7-11-18-9-3-1-4-10-18)17-24-22(20-14-8-16-26-20)19-12-5-2-6-13-19/h1-6,8-10,12-14,16,22,24H,7,11,15,17H2,(H,23,25)/t22-/m1/s1.
What are the key properties of 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide?
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide has a molecular weight of 348.45 g/mol, XLogP of 3.71, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-phenylpropyl)acetamide is sourced from PubChem (CID 8696124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).