N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide

C16H19NO3 — CID 47043832

IUPACN-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide
SMILESCC(C)OCc1ccc(CNC(=O)c2ccoc2)cc1
InChIInChI=1S/C16H19NO3/c1-12(2)20-10-14-5-3-13(4-6-14)9-17-16(18)15-7-8-19-11-15/h3-8,11-12H,9-10H2,1-2H3,(H,17,18)
InChIKeyNRRVGPCTZJDEEB-UHFFFAOYSA-N
MW273.33 g/mol
LogP3.13
Rot. Bonds6

About N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide

N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide (PubChem CID 47043832) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide
PubChem CID47043832
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide
SMILESCC(C)OCc1ccc(CNC(=O)c2ccoc2)cc1
InChIInChI=1S/C16H19NO3/c1-12(2)20-10-14-5-3-13(4-6-14)9-17-16(18)15-7-8-19-11-15/h3-8,11-12H,9-10H2,1-2H3,(H,17,18)
InChIKeyNRRVGPCTZJDEEB-UHFFFAOYSA-N
XLogP3.13
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-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-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide
CID 31544582
3,5-dimethoxy-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]benzamide
CID 47043818
N-[[4-(propan-2-yloxymethyl)phenyl]methyl]-4-propan-2-ylsulfonylbenzamide
CID 55798141
N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
CID 24532506
N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]furan-3-carboxamide
CID 18149564
N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]furan-3-carboxamide
CID 18153751
3,5-dimethyl-N-[2-oxo-2-[[4-(propan-2-yloxymethyl)phenyl]methylamino]ethyl]benzamide
CID 60516567
4-(furan-2-ylmethylsulfamoyl)-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]benzamide
CID 55868652
N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]furan-3-carboxamide
CID 39997651
methyl 5-[(furan-3-carbonylamino)methyl]-2-methoxybenzoate
CID 51265623
N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]furan-3-carboxamide
CID 53159097
N-[4-(methylaminomethyl)phenyl]furan-3-carboxamide
CID 106909959

Frequently Asked Questions

What is the IUPAC name of N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide?
The IUPAC name of N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide (CID 47043832) is N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide.
What is the SMILES notation for N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide?
The canonical SMILES for N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide is CC(C)OCc1ccc(CNC(=O)c2ccoc2)cc1.
What is the InChIKey of N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide?
The InChIKey is NRRVGPCTZJDEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-12(2)20-10-14-5-3-13(4-6-14)9-17-16(18)15-7-8-19-11-15/h3-8,11-12H,9-10H2,1-2H3,(H,17,18).
What are the key properties of N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide?
N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide has a molecular weight of 273.33 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide is sourced from PubChem (CID 47043832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).