N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide

C19H16FN3O2 — CID 173123144

IUPACN-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide
SMILESO=C(NC1CC1)c1ccc2n[nH]c(C=Cc3ccc(F)cc3)c2c1O
InChIInChI=1S/C19H16FN3O2/c20-12-4-1-11(2-5-12)3-9-15-17-16(23-22-15)10-8-14(18(17)24)19(25)21-13-6-7-13/h1-5,8-10,13,24H,6-7H2,(H,21,25)(H,22,23)
InChIKeyPRHNXXZOIBBSJY-UHFFFAOYSA-N
MW337.35 g/mol
LogP3.47
Rot. Bonds4

About N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide

N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide (PubChem CID 173123144) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide
PubChem CID173123144
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC NameN-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide
SMILESO=C(NC1CC1)c1ccc2n[nH]c(C=Cc3ccc(F)cc3)c2c1O
InChIInChI=1S/C19H16FN3O2/c20-12-4-1-11(2-5-12)3-9-15-17-16(23-22-15)10-8-14(18(17)24)19(25)21-13-6-7-13/h1-5,8-10,13,24H,6-7H2,(H,21,25)(H,22,23)
InChIKeyPRHNXXZOIBBSJY-UHFFFAOYSA-N
XLogP3.47
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 53.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide (CID 173123144) is N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide is O=C(NC1CC1)c1ccc2n[nH]c(C=Cc3ccc(F)cc3)c2c1O.
What is the InChIKey of N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide?
The InChIKey is PRHNXXZOIBBSJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c20-12-4-1-11(2-5-12)3-9-15-17-16(23-22-15)10-8-14(18(17)24)19(25)21-13-6-7-13/h1-5,8-10,13,24H,6-7H2,(H,21,25)(H,22,23).
What are the key properties of N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide?
N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide has a molecular weight of 337.35 g/mol, XLogP of 3.47, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[2-(4-fluorophenyl)ethenyl]-4-hydroxy-2H-indazole-5-carboxamide is sourced from PubChem (CID 173123144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).