5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide

C23H21NO4 — CID 35526440

IUPAC5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide
SMILESCC(=O)c1ccc(OCc2ccc(C(=O)Nc3ccc4c(c3)CCC4)o2)cc1
InChIInChI=1S/C23H21NO4/c1-15(25)16-6-9-20(10-7-16)27-14-21-11-12-22(28-21)23(26)24-19-8-5-17-3-2-4-18(17)13-19/h5-13H,2-4,14H2,1H3,(H,24,26)
InChIKeyVXMGUKJPPLZGFL-UHFFFAOYSA-N
MW375.42 g/mol
LogP4.80
Rot. Bonds6

About 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide

5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide (PubChem CID 35526440) has the molecular formula C23H21NO4 and a molecular weight of 375.42 g/mol. Its IUPAC name is 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide
PubChem CID35526440
Molecular FormulaC23H21NO4
Molecular Weight375.42 g/mol
Exact Mass375.15
IUPAC Name5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide
SMILESCC(=O)c1ccc(OCc2ccc(C(=O)Nc3ccc4c(c3)CCC4)o2)cc1
InChIInChI=1S/C23H21NO4/c1-15(25)16-6-9-20(10-7-16)27-14-21-11-12-22(28-21)23(26)24-19-8-5-17-3-2-4-18(17)13-19/h5-13H,2-4,14H2,1H3,(H,24,26)
InChIKeyVXMGUKJPPLZGFL-UHFFFAOYSA-N
XLogP4.80
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.42
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dihydro-1H-inden-5-yl)-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35524166
N-(4-acetamidophenyl)-5-[(4-acetylphenoxy)methyl]furan-2-carboxamide
CID 19455187
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(3-methoxyphenyl)furan-2-carboxamide
CID 19458853
5-[(4-acetylphenoxy)methyl]-N-pyridin-4-ylfuran-2-carboxamide
CID 19455200
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-pyridin-3-ylfuran-2-carboxamide
CID 39853783
N-(3-acetylphenyl)-5-[(4-methoxyphenoxy)methyl]furan-2-carboxamide
CID 53054149
N-(4-acetylphenyl)-5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxamide
CID 19416966
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide
CID 19458809
5-[(4-acetylphenoxy)methyl]-N-[3-chloro-4-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19455289
5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
CID 19455175
N-(2,3-dihydro-1H-inden-5-yl)-4-ethoxybenzamide
CID 2673454
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide
CID 34852480

Frequently Asked Questions

What is the IUPAC name of 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide?
The IUPAC name of 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide (CID 35526440) is 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide.
What is the SMILES notation for 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide?
The canonical SMILES for 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide is CC(=O)c1ccc(OCc2ccc(C(=O)Nc3ccc4c(c3)CCC4)o2)cc1.
What is the InChIKey of 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide?
The InChIKey is VXMGUKJPPLZGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO4/c1-15(25)16-6-9-20(10-7-16)27-14-21-11-12-22(28-21)23(26)24-19-8-5-17-3-2-4-18(17)13-19/h5-13H,2-4,14H2,1H3,(H,24,26).
What are the key properties of 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide?
5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide has a molecular weight of 375.42 g/mol, XLogP of 4.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide is sourced from PubChem (CID 35526440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).