5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide

C22H15FN2O4 — CID 18272087

IUPAC5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1cc2ccccc2cc1O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C22H15FN2O4/c23-16-7-5-13(6-8-16)19-9-10-20(29-19)22(28)25-24-21(27)17-11-14-3-1-2-4-15(14)12-18(17)26/h1-12,26H,(H,24,27)(H,25,28)
InChIKeyKAKJAWHFQQAFHC-UHFFFAOYSA-N
MW390.37 g/mol
LogP4.02
Rot. Bonds3

About 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide

5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide (PubChem CID 18272087) has the molecular formula C22H15FN2O4 and a molecular weight of 390.37 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide
PubChem CID18272087
Molecular FormulaC22H15FN2O4
Molecular Weight390.37 g/mol
Exact Mass390.10
IUPAC Name5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1cc2ccccc2cc1O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C22H15FN2O4/c23-16-7-5-13(6-8-16)19-9-10-20(29-19)22(28)25-24-21(27)17-11-14-3-1-2-4-15(14)12-18(17)26/h1-12,26H,(H,24,27)(H,25,28)
InChIKeyKAKJAWHFQQAFHC-UHFFFAOYSA-N
XLogP4.02
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.37
LogP ≤ 54.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[2-(4-fluorophenyl)acetyl]-3-hydroxynaphthalene-2-carbohydrazide
CID 31725615
N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide
CID 9084734
5-(4-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]furan-2-carbohydrazide
CID 31725805
N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide
CID 24900153
methyl (2S)-3-[4-(4-fluorophenyl)phenyl]-2-[(3-hydroxynaphthalene-2-carbonyl)amino]propanoate
CID 69207172
5-(4-fluorophenyl)-N'-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)furan-2-carbohydrazide
CID 18871656
(4-fluorophenyl)methyl 3-hydroxynaphthalene-2-carboxylate
CID 977864
2-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamoyl]benzoic acid
CID 969323
N-(2-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 3436050
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 51475340
N-[2-(cyclopropylcarbamoyl)phenyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 29353067
5-(4-fluorophenyl)-N-propan-2-ylfuran-2-carboxamide
CID 4290851

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide?
The IUPAC name of 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide (CID 18272087) is 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide.
What is the SMILES notation for 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide?
The canonical SMILES for 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide is O=C(NNC(=O)c1cc2ccccc2cc1O)c1ccc(-c2ccc(F)cc2)o1.
What is the InChIKey of 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide?
The InChIKey is KAKJAWHFQQAFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN2O4/c23-16-7-5-13(6-8-16)19-9-10-20(29-19)22(28)25-24-21(27)17-11-14-3-1-2-4-15(14)12-18(17)26/h1-12,26H,(H,24,27)(H,25,28).
What are the key properties of 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide?
5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide has a molecular weight of 390.37 g/mol, XLogP of 4.02, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide is sourced from PubChem (CID 18272087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).