N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide

C26H20FN3O — CID 67564592

IUPACN-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide
SMILESO=C(Nc1ccc2c(c1)C(c1ccc(F)cc1)NN2)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H20FN3O/c27-21-12-10-19(11-13-21)25-23-16-22(14-15-24(23)29-30-25)28-26(31)20-8-6-18(7-9-20)17-4-2-1-3-5-17/h1-16,25,29-30H,(H,28,31)
InChIKeySCDZOCVVQGIHJZ-UHFFFAOYSA-N
MW409.46 g/mol
LogP5.76
Rot. Bonds4

About N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide

N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide (PubChem CID 67564592) has the molecular formula C26H20FN3O and a molecular weight of 409.46 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide
PubChem CID67564592
Molecular FormulaC26H20FN3O
Molecular Weight409.46 g/mol
Exact Mass409.16
IUPAC NameN-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide
SMILESO=C(Nc1ccc2c(c1)C(c1ccc(F)cc1)NN2)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H20FN3O/c27-21-12-10-19(11-13-21)25-23-16-22(14-15-24(23)29-30-25)28-26(31)20-8-6-18(7-9-20)17-4-2-1-3-5-17/h1-16,25,29-30H,(H,28,31)
InChIKeySCDZOCVVQGIHJZ-UHFFFAOYSA-N
XLogP5.76
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.46
LogP ≤ 55.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide 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-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-2-hydroxybenzamide
CID 142112737
N-(4-cyclopropylphenyl)-4-phenylbenzamide
CID 123874228
4-phenyl-N-[4-(2-phenylcyclopropyl)phenyl]benzamide
CID 144638374
4-[3-[(4-fluorobenzoyl)amino]phenyl]-N-hydroxybenzamide
CID 10308934
N-(2,5-difluorophenyl)-4-phenylbenzamide
CID 7958887
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
N-naphthalen-2-yl-4-phenylbenzamide
CID 1228216
N-(4-fluorophenyl)-4-[(4-phenylphenyl)sulfonylamino]benzamide
CID 46386313
[2-[4-[(4-phenylbenzoyl)amino]phenyl]cyclopropyl]carbamic acid
CID 90214035
4-benzoyl-N-(4-fluorophenyl)benzamide
CID 2315903
4-fluoro-N-[2-[(4-fluorobenzoyl)amino]-6,12-diphenylbenzo[c][1,5]benzodiazocin-8-yl]benzamide
CID 3993300
4-(4-fluorophenyl)-N-pyridin-4-ylbenzamide
CID 135137810

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide?
The IUPAC name of N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide (CID 67564592) is N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide?
The canonical SMILES for N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide is O=C(Nc1ccc2c(c1)C(c1ccc(F)cc1)NN2)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide?
The InChIKey is SCDZOCVVQGIHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20FN3O/c27-21-12-10-19(11-13-21)25-23-16-22(14-15-24(23)29-30-25)28-26(31)20-8-6-18(7-9-20)17-4-2-1-3-5-17/h1-16,25,29-30H,(H,28,31).
What are the key properties of N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide?
N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide has a molecular weight of 409.46 g/mol, XLogP of 5.76, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenyl)-2,3-dihydro-1H-indazol-5-yl]-4-phenylbenzamide is sourced from PubChem (CID 67564592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).