5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide

C19H18FN3O3 — CID 126787957

IUPAC5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide
SMILESO=C(NC1CCc2[nH]ncc2C1)c1ccc(COc2ccc(F)cc2)o1
InChIInChI=1S/C19H18FN3O3/c20-13-1-4-15(5-2-13)25-11-16-6-8-18(26-16)19(24)22-14-3-7-17-12(9-14)10-21-23-17/h1-2,4-6,8,10,14H,3,7,9,11H2,(H,21,23)(H,22,24)
InChIKeyTUYCLGHCFCYQOR-UHFFFAOYSA-N
MW355.37 g/mol
LogP3.01
Rot. Bonds5

About 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide

5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide (PubChem CID 126787957) has the molecular formula C19H18FN3O3 and a molecular weight of 355.37 g/mol. Its IUPAC name is 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide
PubChem CID126787957
Molecular FormulaC19H18FN3O3
Molecular Weight355.37 g/mol
Exact Mass355.13
IUPAC Name5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide
SMILESO=C(NC1CCc2[nH]ncc2C1)c1ccc(COc2ccc(F)cc2)o1
InChIInChI=1S/C19H18FN3O3/c20-13-1-4-15(5-2-13)25-11-16-6-8-18(26-16)19(24)22-14-3-7-17-12(9-14)10-21-23-17/h1-2,4-6,8,10,14H,3,7,9,11H2,(H,21,23)(H,22,24)
InChIKeyTUYCLGHCFCYQOR-UHFFFAOYSA-N
XLogP3.01
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.37
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide with MolForge

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Related Compounds

N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
CID 46476770
1-(cyclopropylmethyl)-1-[(4-fluorophenyl)methyl]-3-[(5S)-4,5,6,7-tetrahydro-1H-indazol-5-yl]urea
CID 97078031
N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide
CID 43066719
N-cyclopropyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19446522
5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
CID 19455175
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
5-[(4-fluorophenoxy)methyl]-N-(2-pyrrolidin-3-ylethyl)furan-2-carboxamide
CID 119533354
methyl 4-[[5-(cyclododecylcarbamoyl)furan-2-yl]methoxy]benzoate
CID 17024109
N-cycloheptyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 1011914
N'-benzoyl-5-[(4-fluorophenoxy)methyl]furan-2-carbohydrazide
CID 27555711

Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide?
The IUPAC name of 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide (CID 126787957) is 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide.
What is the SMILES notation for 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide?
The canonical SMILES for 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide is O=C(NC1CCc2[nH]ncc2C1)c1ccc(COc2ccc(F)cc2)o1.
What is the InChIKey of 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide?
The InChIKey is TUYCLGHCFCYQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3/c20-13-1-4-15(5-2-13)25-11-16-6-8-18(26-16)19(24)22-14-3-7-17-12(9-14)10-21-23-17/h1-2,4-6,8,10,14H,3,7,9,11H2,(H,21,23)(H,22,24).
What are the key properties of 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide?
5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide has a molecular weight of 355.37 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide is sourced from PubChem (CID 126787957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).