2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide

C10H9F3N4O — CID 71192936

IUPAC2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide
SMILESNC(=O)CNc1n[nH]c2ccc(C(F)(F)F)cc12
InChIInChI=1S/C10H9F3N4O/c11-10(12,13)5-1-2-7-6(3-5)9(17-16-7)15-4-8(14)18/h1-3H,4H2,(H2,14,18)(H2,15,16,17)
InChIKeySGFQFFMGOJCIQU-UHFFFAOYSA-N
MW258.20 g/mol
LogP1.48
Rot. Bonds3

About 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide

2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide (PubChem CID 71192936) has the molecular formula C10H9F3N4O and a molecular weight of 258.20 g/mol. Its IUPAC name is 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide.

Molecular Properties

Compound Name2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide
PubChem CID71192936
Molecular FormulaC10H9F3N4O
Molecular Weight258.20 g/mol
Exact Mass258.07
IUPAC Name2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide
SMILESNC(=O)CNc1n[nH]c2ccc(C(F)(F)F)cc12
InChIInChI=1S/C10H9F3N4O/c11-10(12,13)5-1-2-7-6(3-5)9(17-16-7)15-4-8(14)18/h1-3H,4H2,(H2,14,18)(H2,15,16,17)
InChIKeySGFQFFMGOJCIQU-UHFFFAOYSA-N
XLogP1.48
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.20
LogP ≤ 51.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[6-(trifluoromethyl)quinolin-4-yl]amino]acetamide
CID 141322057
2-(methylamino)-1-[6-(trifluoromethyl)-1H-indazol-3-yl]ethanone
CID 84709123
N-[N'-tert-butyl-N-[5-(trifluoromethyl)-1H-indazol-3-yl]carbamimidoyl]-3,4-difluorobenzamide
CID 123338537
2-[4-oxo-6-(trifluoromethyl)-1H-quinolin-2-yl]acetamide
CID 25174759
N-[[4-(trifluoromethyl)phenyl]methyl]-1H-indazol-3-amine
CID 171594927
3-[[2-(azetidin-3-ylamino)-2-oxoethyl]amino]-5-(trifluoromethyl)indazole-1-carboxamide
CID 123686404
N-[1-[1-(5-benzyl-1,3-dioxol-4-yl)cyclohexyl]azetidin-3-yl]-2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide
CID 67478842
N-(1H-indazol-3-yl)-2-methyl-2-[4-(trifluoromethyl)phenyl]propanamide
CID 155963071
1-[(4R)-4-[(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl)methyl]-1-(oxolan-3-yl)pyrrolidin-3-yl]-3-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]propan-2-one
CID 160552515
1-[(4R)-4-[(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl)oxy]-1-(oxolan-3-yl)pyrrolidin-3-yl]-3-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]propan-2-one
CID 157356522
N-(2-azabicyclo[3.1.0]hexan-4-yl)-5-(trifluoromethyl)-1H-indazole-3-carboxamide
CID 167793305
N-[6-(trifluoromethyl)-1H-indazol-3-yl]-1H-pyrrole-2-carboxamide
CID 162634789

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide?
The IUPAC name of 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide (CID 71192936) is 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide.
What is the SMILES notation for 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide?
The canonical SMILES for 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide is NC(=O)CNc1n[nH]c2ccc(C(F)(F)F)cc12.
What is the InChIKey of 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide?
The InChIKey is SGFQFFMGOJCIQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4O/c11-10(12,13)5-1-2-7-6(3-5)9(17-16-7)15-4-8(14)18/h1-3H,4H2,(H2,14,18)(H2,15,16,17).
What are the key properties of 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide?
2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide has a molecular weight of 258.20 g/mol, XLogP of 1.48, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide is sourced from PubChem (CID 71192936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).