N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide

C18H13FN6O — CID 166996869

IUPACN-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide
SMILESC#CCc1c(F)c(C)c(-c2cn3cc(NC=O)nc3cn2)c2cn[nH]c12
InChIInChI=1S/C18H13FN6O/c1-3-4-11-17(19)10(2)16(12-5-22-24-18(11)12)13-7-25-8-14(21-9-26)23-15(25)6-20-13/h1,5-9H,4H2,2H3,(H,21,26)(H,22,24)
InChIKeySAWJENRJXBVIFD-UHFFFAOYSA-N
MW348.34 g/mol
LogP2.46
Rot. Bonds4

About N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide

N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide (PubChem CID 166996869) has the molecular formula C18H13FN6O and a molecular weight of 348.34 g/mol. Its IUPAC name is N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide.

Molecular Properties

Compound NameN-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide
PubChem CID166996869
Molecular FormulaC18H13FN6O
Molecular Weight348.34 g/mol
Exact Mass348.11
IUPAC NameN-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide
SMILESC#CCc1c(F)c(C)c(-c2cn3cc(NC=O)nc3cn2)c2cn[nH]c12
InChIInChI=1S/C18H13FN6O/c1-3-4-11-17(19)10(2)16(12-5-22-24-18(11)12)13-7-25-8-14(21-9-26)23-15(25)6-20-13/h1,5-9H,4H2,2H3,(H,21,26)(H,22,24)
InChIKeySAWJENRJXBVIFD-UHFFFAOYSA-N
XLogP2.46
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.34
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide 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

N-[4-(dimethylphosphoryl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)ethenyl]-9H-purin-6-amine
CID 44517648
2-(1h-Indazol-5-yl)-n-isopropylimidazo[1,2-a]pyrimidin-3-amine
CID 25167074
n-Butyl-2-(1h-indazol-5-yl)imidazo[1,2-a]pyrimidin-3-amine
CID 25167277
4-imidazo[1,2-a]pyridin-6-yl-6-(trifluoromethyl)-1H-indazole
CID 71735207
3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)imidazo[1,2-a]pyrazine
CID 135227315
3-(4-Fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(perfluoroethyl)phenyl]-2-(trifluoromethyl)imidazo[1,2-a]pyrazine
CID 135227333
3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazine
CID 135227335
2-ethyl-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine
CID 135227342
3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazine
CID 135227343
3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(2,2,2-trifluoroethyl)phenyl]-2-(trifluoromethyl)imidazo[1,2-a]pyrazine
CID 135227344
3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)-2-propan-2-ylimidazo[1,2-a]pyrazine
CID 135227347
2-cyclobutyl-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine
CID 135227348

Frequently Asked Questions

What is the IUPAC name of N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide?
The IUPAC name of N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide (CID 166996869) is N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide.
What is the SMILES notation for N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide?
The canonical SMILES for N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide is C#CCc1c(F)c(C)c(-c2cn3cc(NC=O)nc3cn2)c2cn[nH]c12.
What is the InChIKey of N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide?
The InChIKey is SAWJENRJXBVIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN6O/c1-3-4-11-17(19)10(2)16(12-5-22-24-18(11)12)13-7-25-8-14(21-9-26)23-15(25)6-20-13/h1,5-9H,4H2,2H3,(H,21,26)(H,22,24).
What are the key properties of N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide?
N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide has a molecular weight of 348.34 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide is sourced from PubChem (CID 166996869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).