N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide

C19H21F2NO3 — CID 19453107

IUPACN-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1ccc(COc2ccc(F)cc2F)o1
InChIInChI=1S/C19H21F2NO3/c20-13-7-9-17(16(21)11-13)24-12-15-8-10-18(25-15)19(23)22-14-5-3-1-2-4-6-14/h7-11,14H,1-6,12H2,(H,22,23)
InChIKeyOJNJDVGCYMOHHB-UHFFFAOYSA-N
MW349.38 g/mol
LogP4.59
Rot. Bonds5

About N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide

N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide (PubChem CID 19453107) has the molecular formula C19H21F2NO3 and a molecular weight of 349.38 g/mol. Its IUPAC name is N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
PubChem CID19453107
Molecular FormulaC19H21F2NO3
Molecular Weight349.38 g/mol
Exact Mass349.15
IUPAC NameN-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1ccc(COc2ccc(F)cc2F)o1
InChIInChI=1S/C19H21F2NO3/c20-13-7-9-17(16(21)11-13)24-12-15-8-10-18(25-15)19(23)22-14-5-3-1-2-4-6-14/h7-11,14H,1-6,12H2,(H,22,23)
InChIKeyOJNJDVGCYMOHHB-UHFFFAOYSA-N
XLogP4.59
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.38
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]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

5-[(2,4-difluorophenoxy)methyl]-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)furan-2-carboxamide
CID 19453314
5-[(4-chloro-2-methylphenoxy)methyl]-N-cyclohexylfuran-2-carboxamide
CID 19457491
N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
CID 19452624
N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
N-cyclooctyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912047
N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19461005
N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
CID 19453113
5-[(2,4-difluorophenoxy)methyl]-N-(4,6-dimethylpyrimidin-2-yl)furan-2-carboxamide
CID 35336375
5-[(2-chloro-5-nitrophenoxy)methyl]-N-cycloheptylfuran-2-carboxamide
CID 19459447
N-cyclopentyl-5-[(2,4,6-trichlorophenoxy)methyl]furan-2-carboxamide
CID 19415446
N-cycloheptyl-5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carboxamide
CID 19458831
5-[(4-tert-butylphenoxy)methyl]-N-cyclohexylfuran-2-carboxamide
CID 998142

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide (CID 19453107) is N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide is O=C(NC1CCCCCC1)c1ccc(COc2ccc(F)cc2F)o1.
What is the InChIKey of N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
The InChIKey is OJNJDVGCYMOHHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2NO3/c20-13-7-9-17(16(21)11-13)24-12-15-8-10-18(25-15)19(23)22-14-5-3-1-2-4-6-14/h7-11,14H,1-6,12H2,(H,22,23).
What are the key properties of N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide has a molecular weight of 349.38 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19453107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).