N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide

C19H25NO5 — CID 78824780

IUPACN-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide
SMILESCCOc1ccc(C(C)NC(=O)c2ccc(COC)o2)cc1OCC
InChIInChI=1S/C19H25NO5/c1-5-23-16-9-7-14(11-18(16)24-6-2)13(3)20-19(21)17-10-8-15(25-17)12-22-4/h7-11,13H,5-6,12H2,1-4H3,(H,20,21)
InChIKeyPAYYCNLZAUMRJF-UHFFFAOYSA-N
MW347.41 g/mol
LogP3.71
Rot. Bonds9

About N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide

N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide (PubChem CID 78824780) has the molecular formula C19H25NO5 and a molecular weight of 347.41 g/mol. Its IUPAC name is N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide
PubChem CID78824780
Molecular FormulaC19H25NO5
Molecular Weight347.41 g/mol
Exact Mass347.17
IUPAC NameN-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide
SMILESCCOc1ccc(C(C)NC(=O)c2ccc(COC)o2)cc1OCC
InChIInChI=1S/C19H25NO5/c1-5-23-16-9-7-14(11-18(16)24-6-2)13(3)20-19(21)17-10-8-15(25-17)12-22-4/h7-11,13H,5-6,12H2,1-4H3,(H,20,21)
InChIKeyPAYYCNLZAUMRJF-UHFFFAOYSA-N
XLogP3.71
TPSA69.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.41
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(3,4-diethoxyphenyl)ethyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 43011698
5-(methoxymethyl)-N-[1-(3-methoxy-4-propan-2-yloxyphenyl)ethyl]furan-2-carboxamide
CID 78867521
N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4-(methoxymethyl)benzamide
CID 8620540
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-(methoxymethyl)furan-2-carboxamide
CID 78824798
N-[1-(3,4-diethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide
CID 78808076
N-[1-(3-bromophenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide
CID 86925221
N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-2,4,5-trimethylfuran-3-carboxamide
CID 46418044
5-(methoxymethyl)-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]furan-2-carboxamide
CID 78890847
N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3,5-dimethylbenzamide
CID 7936483
5-[(2-methoxyphenoxy)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529733
5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529730
N-[1-(3,4-diethoxyphenyl)ethyl]furan-3-carboxamide
CID 46415111

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide (CID 78824780) is N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide is CCOc1ccc(C(C)NC(=O)c2ccc(COC)o2)cc1OCC.
What is the InChIKey of N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
The InChIKey is PAYYCNLZAUMRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO5/c1-5-23-16-9-7-14(11-18(16)24-6-2)13(3)20-19(21)17-10-8-15(25-17)12-22-4/h7-11,13H,5-6,12H2,1-4H3,(H,20,21).
What are the key properties of N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide has a molecular weight of 347.41 g/mol, XLogP of 3.71, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-diethoxyphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 78824780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).