3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide

C14H10F2N4O — CID 25197650

IUPAC3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide
SMILESNc1nn(C(=O)Nc2c(F)cccc2F)c2ccccc12
InChIInChI=1S/C14H10F2N4O/c15-9-5-3-6-10(16)12(9)18-14(21)20-11-7-2-1-4-8(11)13(17)19-20/h1-7H,(H2,17,19)(H,18,21)
InChIKeyCWARILVGRFFNPY-UHFFFAOYSA-N
MW288.26 g/mol
LogP2.98
Rot. Bonds1

About 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide

3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide (PubChem CID 25197650) has the molecular formula C14H10F2N4O and a molecular weight of 288.26 g/mol. Its IUPAC name is 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide
PubChem CID25197650
Molecular FormulaC14H10F2N4O
Molecular Weight288.26 g/mol
Exact Mass288.08
IUPAC Name3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide
SMILESNc1nn(C(=O)Nc2c(F)cccc2F)c2ccccc12
InChIInChI=1S/C14H10F2N4O/c15-9-5-3-6-10(16)12(9)18-14(21)20-11-7-2-1-4-8(11)13(17)19-20/h1-7H,(H2,17,19)(H,18,21)
InChIKeyCWARILVGRFFNPY-UHFFFAOYSA-N
XLogP2.98
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.26
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide?
The IUPAC name of 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide (CID 25197650) is 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide?
The canonical SMILES for 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide is Nc1nn(C(=O)Nc2c(F)cccc2F)c2ccccc12.
What is the InChIKey of 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide?
The InChIKey is CWARILVGRFFNPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N4O/c15-9-5-3-6-10(16)12(9)18-14(21)20-11-7-2-1-4-8(11)13(17)19-20/h1-7H,(H2,17,19)(H,18,21).
What are the key properties of 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide?
3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide has a molecular weight of 288.26 g/mol, XLogP of 2.98, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,6-difluorophenyl)indazole-1-carboxamide is sourced from PubChem (CID 25197650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).