N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide

C19H17NO3 — CID 7464174

IUPACN-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(COc3ccccc3)o2)c1
InChIInChI=1S/C19H17NO3/c1-14-6-5-7-15(12-14)20-19(21)18-11-10-17(23-18)13-22-16-8-3-2-4-9-16/h2-12H,13H2,1H3,(H,20,21)
InChIKeyPQYWNBOLMJKLKM-UHFFFAOYSA-N
MW307.35 g/mol
LogP4.42
Rot. Bonds5

About N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide

N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide (PubChem CID 7464174) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide
PubChem CID7464174
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC NameN-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(COc3ccccc3)o2)c1
InChIInChI=1S/C19H17NO3/c1-14-6-5-7-15(12-14)20-19(21)18-11-10-17(23-18)13-22-16-8-3-2-4-9-16/h2-12H,13H2,1H3,(H,20,21)
InChIKeyPQYWNBOLMJKLKM-UHFFFAOYSA-N
XLogP4.42
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(4-methylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 7454734
N-(3-cyanophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 9245570
2-hydroxy-4-[[5-[(3-methylphenoxy)methyl]furan-2-carbonyl]amino]benzoic acid
CID 4899963
5-[(3,4-dimethylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 19450839
N-(2,6-dimethylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
CID 19465597
5-(phenoxymethyl)-N-(3-sulfamoylphenyl)furan-2-carboxamide
CID 9413056
3-[[5-[(4-phenylphenoxy)methyl]furan-2-carbonyl]amino]benzoic acid
CID 17386602
5-[(3,5-dimethylphenoxy)methyl]-N-(4-phenylphenyl)furan-2-carboxamide
CID 19463303
N-(3,4-dimethylphenyl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 18830628
N-(3-acetylphenyl)-5-[(4-methoxyphenoxy)methyl]furan-2-carboxamide
CID 53054149
N-(3-chloro-4-methoxyphenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7341802
N-methyl-5-(phenoxymethyl)furan-2-carboxamide
CID 7678218

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide?
The IUPAC name of N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide (CID 7464174) is N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide is Cc1cccc(NC(=O)c2ccc(COc3ccccc3)o2)c1.
What is the InChIKey of N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide?
The InChIKey is PQYWNBOLMJKLKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c1-14-6-5-7-15(12-14)20-19(21)18-11-10-17(23-18)13-22-16-8-3-2-4-9-16/h2-12H,13H2,1H3,(H,20,21).
What are the key properties of N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide?
N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 7464174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).