1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide

C23H26FN3O2 — CID 164625585

IUPAC1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide
SMILESCC(C)(O)C1CCC(NC(=O)c2ccc3c(cnn3-c3cccc(F)c3)c2)CC1
InChIInChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)26-22(28)15-6-11-21-16(12-15)14-25-27(21)20-5-3-4-18(24)13-20/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,26,28)
InChIKeyAWJZSXZTZBLZIA-UHFFFAOYSA-N
MW395.48 g/mol
LogP4.22
Rot. Bonds4

About 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide

1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide (PubChem CID 164625585) has the molecular formula C23H26FN3O2 and a molecular weight of 395.48 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide.

Molecular Properties

Compound Name1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide
PubChem CID164625585
Molecular FormulaC23H26FN3O2
Molecular Weight395.48 g/mol
Exact Mass395.20
IUPAC Name1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide
SMILESCC(C)(O)C1CCC(NC(=O)c2ccc3c(cnn3-c3cccc(F)c3)c2)CC1
InChIInChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)26-22(28)15-6-11-21-16(12-15)14-25-27(21)20-5-3-4-18(24)13-20/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,26,28)
InChIKeyAWJZSXZTZBLZIA-UHFFFAOYSA-N
XLogP4.22
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide?
The IUPAC name of 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide (CID 164625585) is 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide.
What is the SMILES notation for 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide?
The canonical SMILES for 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide is CC(C)(O)C1CCC(NC(=O)c2ccc3c(cnn3-c3cccc(F)c3)c2)CC1.
What is the InChIKey of 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide?
The InChIKey is AWJZSXZTZBLZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)26-22(28)15-6-11-21-16(12-15)14-25-27(21)20-5-3-4-18(24)13-20/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,26,28).
What are the key properties of 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide?
1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide has a molecular weight of 395.48 g/mol, XLogP of 4.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]indazole-5-carboxamide is sourced from PubChem (CID 164625585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).