5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide

C21H19NO4 — CID 19458809

IUPAC5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccccc1O)c1ccc(COc2ccc3c(c2)CCC3)o1
InChIInChI=1S/C21H19NO4/c23-19-7-2-1-6-18(19)22-21(24)20-11-10-17(26-20)13-25-16-9-8-14-4-3-5-15(14)12-16/h1-2,6-12,23H,3-5,13H2,(H,22,24)
InChIKeyWODSKDBIVNIGMK-UHFFFAOYSA-N
MW349.39 g/mol
LogP4.31
Rot. Bonds5

About 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide

5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide (PubChem CID 19458809) has the molecular formula C21H19NO4 and a molecular weight of 349.39 g/mol. Its IUPAC name is 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide
PubChem CID19458809
Molecular FormulaC21H19NO4
Molecular Weight349.39 g/mol
Exact Mass349.13
IUPAC Name5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccccc1O)c1ccc(COc2ccc3c(c2)CCC3)o1
InChIInChI=1S/C21H19NO4/c23-19-7-2-1-6-18(19)22-21(24)20-11-10-17(26-20)13-25-16-9-8-14-4-3-5-15(14)12-16/h1-2,6-12,23H,3-5,13H2,(H,22,24)
InChIKeyWODSKDBIVNIGMK-UHFFFAOYSA-N
XLogP4.31
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-hydroxyphenyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460984
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide
CID 34852480
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-pyridin-3-ylfuran-2-carboxamide
CID 39853783
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(3-methoxyphenyl)furan-2-carboxamide
CID 19458853
N-cycloheptyl-5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carboxamide
CID 19458831
4-[[5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carbonyl]amino]-N,1-dimethylpyrazole-3-carboxamide
CID 19459051
N-(2,3-dihydro-1H-inden-5-yl)-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35524166
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(1-phenylpropyl)furan-2-carboxamide
CID 19458901
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-[(4-methylphenyl)methoxy]furan-2-carboxamide
CID 3461178
5-[(4-acetylphenoxy)methyl]-N-(2,3-dihydro-1H-inden-5-yl)furan-2-carboxamide
CID 35526440
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
CID 19458923
N-[1-[(2-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carboxamide
CID 19459011

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide (CID 19458809) is 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide is O=C(Nc1ccccc1O)c1ccc(COc2ccc3c(c2)CCC3)o1.
What is the InChIKey of 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide?
The InChIKey is WODSKDBIVNIGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO4/c23-19-7-2-1-6-18(19)22-21(24)20-11-10-17(26-20)13-25-16-9-8-14-4-3-5-15(14)12-16/h1-2,6-12,23H,3-5,13H2,(H,22,24).
What are the key properties of 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide?
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 4.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 19458809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).