1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide

C18H14F3N5O — CID 167762153

IUPAC1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide
SMILESCc1cc2nccc(NC(=O)c3cc4cc(C(F)(F)F)ccc4n3C)n2n1
InChIInChI=1S/C18H14F3N5O/c1-10-7-16-22-6-5-15(26(16)24-10)23-17(27)14-9-11-8-12(18(19,20)21)3-4-13(11)25(14)2/h3-9H,1-2H3,(H,23,27)
InChIKeyIRXLAVIVLWOYBG-UHFFFAOYSA-N
MW373.34 g/mol
LogP3.80
Rot. Bonds2

About 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide

1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide (PubChem CID 167762153) has the molecular formula C18H14F3N5O and a molecular weight of 373.34 g/mol. Its IUPAC name is 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide
PubChem CID167762153
Molecular FormulaC18H14F3N5O
Molecular Weight373.34 g/mol
Exact Mass373.12
IUPAC Name1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide
SMILESCc1cc2nccc(NC(=O)c3cc4cc(C(F)(F)F)ccc4n3C)n2n1
InChIInChI=1S/C18H14F3N5O/c1-10-7-16-22-6-5-15(26(16)24-10)23-17(27)14-9-11-8-12(18(19,20)21)3-4-13(11)25(14)2/h3-9H,1-2H3,(H,23,27)
InChIKeyIRXLAVIVLWOYBG-UHFFFAOYSA-N
XLogP3.80
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.34
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-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

Danicopan
CID 118323590
Pimitespib
CID 67501411
4-(3-fluoroazetidine-1-carbonyl)-1-methyl-N-(2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
CID 57377630
N-(3-(1H-imidazol-1-yl)propyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3113005
2-[6-(diethylamino)pyridin-3-yl]-1-[(1-ethyl-1H-pyrazol-3-yl)methyl]-N-methyl-1H-1,3-benzodiazole-5-carboxamide
CID 138466007
1-(3-carbamimidoylphenyl)-N-(2-fluoro-4-{1H-imidazo[4,5-b]pyridin-1-yl}phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 23646189
1-(3-carbamimidoylphenyl)-N-(2-fluoro-4-{3H-imidazo[4,5-b]pyridin-3-yl}phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 23646192
1-[5-(4-Amino-7-methylpyrrolo[2,3-d]pyrimidin-5-yl)indol-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone
CID 57519740
B-Raf IN 1
CID 24884503
3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-N-[3-imidazol-1-yl-5-(trifluoromethyl)phenyl]-4-methylbenzamide
CID 58945732
3-methyl-4-{4-[4-(1-methyl-1H-pyrazol-4-yl)-1H-imidazol-1-yl]-3-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl}benzamide
CID 67501021
1-methyl-5-[2-(2-methylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-N-[(1S)-1-phenylethyl]indole-3-carboxamide
CID 168007913

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide?
The IUPAC name of 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide (CID 167762153) is 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide.
What is the SMILES notation for 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide?
The canonical SMILES for 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide is Cc1cc2nccc(NC(=O)c3cc4cc(C(F)(F)F)ccc4n3C)n2n1.
What is the InChIKey of 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide?
The InChIKey is IRXLAVIVLWOYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3N5O/c1-10-7-16-22-6-5-15(26(16)24-10)23-17(27)14-9-11-8-12(18(19,20)21)3-4-13(11)25(14)2/h3-9H,1-2H3,(H,23,27).
What are the key properties of 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide?
1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide has a molecular weight of 373.34 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-5-(trifluoromethyl)indole-2-carboxamide is sourced from PubChem (CID 167762153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).