5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide

C19H14FN5O2 — CID 59654655

IUPAC5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(Cc2nn[nH]n2)c1)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C19H14FN5O2/c20-14-6-4-13(5-7-14)16-8-9-17(27-16)19(26)21-15-3-1-2-12(10-15)11-18-22-24-25-23-18/h1-10H,11H2,(H,21,26)(H,22,23,24,25)
InChIKeyFCIZIBWRGNOODT-UHFFFAOYSA-N
MW363.35 g/mol
LogP3.44
Rot. Bonds5

About 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide

5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide (PubChem CID 59654655) has the molecular formula C19H14FN5O2 and a molecular weight of 363.35 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide
PubChem CID59654655
Molecular FormulaC19H14FN5O2
Molecular Weight363.35 g/mol
Exact Mass363.11
IUPAC Name5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(Cc2nn[nH]n2)c1)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C19H14FN5O2/c20-14-6-4-13(5-7-14)16-8-9-17(27-16)19(26)21-15-3-1-2-12(10-15)11-18-22-24-25-23-18/h1-10H,11H2,(H,21,26)(H,22,23,24,25)
InChIKeyFCIZIBWRGNOODT-UHFFFAOYSA-N
XLogP3.44
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.35
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,3,3-trifluoro-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]propanamide
CID 154844252
2-[3-[(5-phenylfuran-2-carbonyl)amino]phenyl]acetic acid
CID 11220940
N-(4-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 18871483
N-[3,5-bis(trifluoromethyl)phenyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 3966272
N-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 27648507
N-[3-chloro-4-(methylcarbamoyl)phenyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 94632130
methyl 2-[3-[[5-(4-methoxyphenyl)furan-2-carbonyl]amino]phenyl]acetate
CID 59654703
N-(3-fluorophenyl)-2-(2H-tetrazol-5-yl)acetamide
CID 110499400
1-(2-methyl-4-phenylphenyl)-3-[3-(2H-tetrazol-5-ylmethyl)phenyl]urea
CID 166399943
N-[4-(cyanomethyl)phenyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 27163463
N-(3-amino-4-methoxyphenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 91689974
methyl 2-[3-[[5-(4-propan-2-ylphenyl)furan-2-carbonyl]amino]phenyl]acetate
CID 59654833

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide (CID 59654655) is 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide is O=C(Nc1cccc(Cc2nn[nH]n2)c1)c1ccc(-c2ccc(F)cc2)o1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide?
The InChIKey is FCIZIBWRGNOODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN5O2/c20-14-6-4-13(5-7-14)16-8-9-17(27-16)19(26)21-15-3-1-2-12(10-15)11-18-22-24-25-23-18/h1-10H,11H2,(H,21,26)(H,22,23,24,25).
What are the key properties of 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide?
5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide has a molecular weight of 363.35 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[3-(2H-tetrazol-5-ylmethyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 59654655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).