N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide

C15H17NO4 — CID 110783199

IUPACN-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccco2)c(OC)c1C
InChIInChI=1S/C15H17NO4/c1-10-12(18-2)7-6-11(14(10)19-3)9-16-15(17)13-5-4-8-20-13/h4-8H,9H2,1-3H3,(H,16,17)
InChIKeyYKJUUHZVOZKMJD-UHFFFAOYSA-N
MW275.30 g/mol
LogP2.54
Rot. Bonds5

About N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide

N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide (PubChem CID 110783199) has the molecular formula C15H17NO4 and a molecular weight of 275.30 g/mol. Its IUPAC name is N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide
PubChem CID110783199
Molecular FormulaC15H17NO4
Molecular Weight275.30 g/mol
Exact Mass275.12
IUPAC NameN-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccco2)c(OC)c1C
InChIInChI=1S/C15H17NO4/c1-10-12(18-2)7-6-11(14(10)19-3)9-16-15(17)13-5-4-8-20-13/h4-8H,9H2,1-3H3,(H,16,17)
InChIKeyYKJUUHZVOZKMJD-UHFFFAOYSA-N
XLogP2.54
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,4-dimethoxy-3-methylphenyl)methyl]-2-(2-methylphenyl)acetamide
CID 110783236
N-[(2-methoxy-4-propan-2-ylphenyl)methyl]furan-2-carboxamide
CID 110782905
N-[(5-chloro-2-methoxy-4-methylphenyl)methyl]furan-2-carboxamide
CID 110781838
N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide
CID 110783214
2-(2,4-dimethoxy-3-methylphenyl)-N-(2-phenylethyl)acetamide
CID 110769821
N-[2-oxo-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]ethyl]furan-2-carboxamide
CID 9069712
N-(naphthalen-1-ylmethyl)furan-2-carboxamide
CID 60675809
N-[(3-tert-butyl-4-methoxyphenyl)methyl]furan-2-carboxamide
CID 110780466
2-cyano-N-[(2,4-dimethoxy-3-methylphenyl)methyl]acetamide
CID 115173101
N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]ethyl]furan-2-carboxamide
CID 24683474
N-[(2-ethoxyphenyl)methyl]furan-2-carboxamide
CID 28635209
N-[(5-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide
CID 60767686

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide (CID 110783199) is N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide is COc1ccc(CNC(=O)c2ccco2)c(OC)c1C.
What is the InChIKey of N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide?
The InChIKey is YKJUUHZVOZKMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4/c1-10-12(18-2)7-6-11(14(10)19-3)9-16-15(17)13-5-4-8-20-13/h4-8H,9H2,1-3H3,(H,16,17).
What are the key properties of N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide?
N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide has a molecular weight of 275.30 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 110783199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).