6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C14H17F3N4O2 — CID 74231241

IUPAC6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(C)[C@@H](NC(=O)c1cnn2cc(CCO)cnc12)C(F)(F)F
InChIInChI=1S/C14H17F3N4O2/c1-8(2)11(14(15,16)17)20-13(23)10-6-19-21-7-9(3-4-22)5-18-12(10)21/h5-8,11,22H,3-4H2,1-2H3,(H,20,23)/t11-/m1/s1
InChIKeyDUWZZQSTZSOQEP-LLVKDONJSA-N
MW330.31 g/mol
LogP1.58
Rot. Bonds5

About 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 74231241) has the molecular formula C14H17F3N4O2 and a molecular weight of 330.31 g/mol. Its IUPAC name is 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID74231241
Molecular FormulaC14H17F3N4O2
Molecular Weight330.31 g/mol
Exact Mass330.13
IUPAC Name6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(C)[C@@H](NC(=O)c1cnn2cc(CCO)cnc12)C(F)(F)F
InChIInChI=1S/C14H17F3N4O2/c1-8(2)11(14(15,16)17)20-13(23)10-6-19-21-7-9(3-4-22)5-18-12(10)21/h5-8,11,22H,3-4H2,1-2H3,(H,20,23)/t11-/m1/s1
InChIKeyDUWZZQSTZSOQEP-LLVKDONJSA-N
XLogP1.58
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.31
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide 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

2-{3-[(8-methyloctahydro-2H-pyrazino[1,2-a]pyrazin-2-yl)carbonyl]pyrazolo[1,5-a]pyrimidin-6-yl}ethanol
CID 50962046
2-(3-{[2-(Trifluoromethyl)morpholin-4-yl]carbonyl}pyrazolo[1,5-a]pyrimidin-6-yl)ethanol
CID 56880306
1,5-anhydro-2,3-dideoxy-3-({[6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-D-threo-pentitol
CID 91797775
6-[(Diethylamino)methyl]-N-[(2R)-2-hydroxypropyl]pyrazolo[1,5-A]pyrimidine-3-carboxamide
CID 56701893
6-[(diethylamino)methyl]-N-(trans-4-hydroxycyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56702046
6-[(Diethylamino)methyl]-N-(2-hydroxybutyl)pyrazolo[1,5-A]pyrimidine-3-carboxamide
CID 56702451
6-[(diethylamino)methyl]-N-(2-hydroxy-1,1-dimethylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56703054
6-[(diethylamino)methyl]-N-(2-hydroxy-1-methylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56758821
7-{[6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one
CID 135990888
6-[(Diethylamino)methyl]-N-(2,2-difluoroethyl)pyrazolo[1,5-A]pyrimidine-3-carboxamide
CID 56703959
6-(2-hydroxyethyl)-N-[trans-4-piperidin-1-yltetrahydrofuran-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 91843191
N-[3-(difluoromethyl)-1-methylidenepyrazol-1-ium-4-yl]-6-ethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 156823348

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 74231241) is 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC(C)[C@@H](NC(=O)c1cnn2cc(CCO)cnc12)C(F)(F)F.
What is the InChIKey of 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is DUWZZQSTZSOQEP-LLVKDONJSA-N. The full InChI is InChI=1S/C14H17F3N4O2/c1-8(2)11(14(15,16)17)20-13(23)10-6-19-21-7-9(3-4-22)5-18-12(10)21/h5-8,11,22H,3-4H2,1-2H3,(H,20,23)/t11-/m1/s1.
What are the key properties of 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 330.31 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyethyl)-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 74231241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).