5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide

C19H21NO4 — CID 19455175

IUPAC5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
SMILESCC(=O)c1ccc(OCc2ccc(C(=O)NC3CCCC3)o2)cc1
InChIInChI=1S/C19H21NO4/c1-13(21)14-6-8-16(9-7-14)23-12-17-10-11-18(24-17)19(22)20-15-4-2-3-5-15/h6-11,15H,2-5,12H2,1H3,(H,20,22)
InChIKeyDDNATSGDEKEQRV-UHFFFAOYSA-N
MW327.38 g/mol
LogP3.73
Rot. Bonds6

About 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide

5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide (PubChem CID 19455175) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide.

Molecular Properties

Compound Name5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
PubChem CID19455175
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Name5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
SMILESCC(=O)c1ccc(OCc2ccc(C(=O)NC3CCCC3)o2)cc1
InChIInChI=1S/C19H21NO4/c1-13(21)14-6-8-16(9-7-14)23-12-17-10-11-18(24-17)19(22)20-15-4-2-3-5-15/h6-11,15H,2-5,12H2,1H3,(H,20,22)
InChIKeyDDNATSGDEKEQRV-UHFFFAOYSA-N
XLogP3.73
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[[5-(cyclododecylcarbamoyl)furan-2-yl]methoxy]benzoate
CID 17024109
5-[(4-acetylphenoxy)methyl]-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)furan-2-carboxamide
CID 19455341
N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
5-[(4-tert-butylphenoxy)methyl]-N-cyclohexylfuran-2-carboxamide
CID 998142
N-cycloheptyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 1011914
5-[[4-(cyclohexylcarbamoyl)phenoxy]methyl]furan-2-carboxylic acid
CID 22683768
N-cyclopropyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19446522
N-cyclooctyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912047
N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19461005
N-cycloheptyl-5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carboxamide
CID 19458831
N-(4-acetamidophenyl)-5-[(4-acetylphenoxy)methyl]furan-2-carboxamide
CID 19455187
N-cyclopropyl-5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]furan-2-carboxamide
CID 19455418

Frequently Asked Questions

What is the IUPAC name of 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide?
The IUPAC name of 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide (CID 19455175) is 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide.
What is the SMILES notation for 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide?
The canonical SMILES for 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide is CC(=O)c1ccc(OCc2ccc(C(=O)NC3CCCC3)o2)cc1.
What is the InChIKey of 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide?
The InChIKey is DDNATSGDEKEQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4/c1-13(21)14-6-8-16(9-7-14)23-12-17-10-11-18(24-17)19(22)20-15-4-2-3-5-15/h6-11,15H,2-5,12H2,1H3,(H,20,22).
What are the key properties of 5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide?
5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 3.73, 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-cyclopentylfuran-2-carboxamide is sourced from PubChem (CID 19455175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).