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

C17H11F4N5O — CID 163221060

IUPACN-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
SMILESCc1c(F)c(C(F)(F)F)c2[nH]ncc2c1-c1ccc2nc(NC=O)cn2c1
InChIInChI=1S/C17H11F4N5O/c1-8-13(9-2-3-12-24-11(22-7-27)6-26(12)5-9)10-4-23-25-16(10)14(15(8)18)17(19,20)21/h2-7H,1H3,(H,22,27)(H,23,25)
InChIKeyKGHJQMDOOWPWAE-UHFFFAOYSA-N
MW377.30 g/mol
LogP3.91
Rot. Bonds3

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

N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide (PubChem CID 163221060) has the molecular formula C17H11F4N5O and a molecular weight of 377.30 g/mol. Its IUPAC name is N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide.

Molecular Properties

Compound NameN-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
PubChem CID163221060
Molecular FormulaC17H11F4N5O
Molecular Weight377.30 g/mol
Exact Mass377.09
IUPAC NameN-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
SMILESCc1c(F)c(C(F)(F)F)c2[nH]ncc2c1-c1ccc2nc(NC=O)cn2c1
InChIInChI=1S/C17H11F4N5O/c1-8-13(9-2-3-12-24-11(22-7-27)6-26(12)5-9)10-4-23-25-16(10)14(15(8)18)17(19,20)21/h2-7H,1H3,(H,22,27)(H,23,25)
InChIKeyKGHJQMDOOWPWAE-UHFFFAOYSA-N
XLogP3.91
TPSA75.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.30
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[6-[5-chloro-6-fluoro-7-(2-hydroxypropan-2-yl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163221360
N-[6-[5-chloro-6-fluoro-7-(propan-2-ylamino)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163221228
N-[6-[5-chloro-7-(ethoxymethyl)-6-fluoro-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163221020
N-[6-[5-chloro-6-fluoro-7-(1-methoxypropyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163220935
N-[6-(6-fluoro-5-methyl-7-prop-2-ynyl-1H-indazol-4-yl)imidazo[1,2-a]pyrazin-2-yl]formamide
CID 166996869
N-[6-(2,6-dimethylphenyl)imidazo[1,2-a]pyridin-2-yl]formamide
CID 154686285
cyclopropane;N-[6-(4-fluoro-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-2-yl]formamide
CID 154686461
N-[6-[7-(cyclopenten-1-yl)-6-fluoro-5-methyl-1H-indazol-4-yl]imidazo[1,2-a]pyrazin-2-yl]formamide
CID 169196011
5-chloro-6-fluoro-N,N-dimethyl-4-[2-(methylamino)imidazo[1,2-a]pyridin-6-yl]-1H-indazol-7-amine
CID 163221163
5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
CID 163221063
cyclopropane;N-[6-[7-[1-(dimethylamino)propan-2-yl]-6-fluoro-5-methyl-1H-indazol-4-yl]imidazo[1,2-a]pyrazin-2-yl]formamide
CID 169196059
N-[6-[7-(1-aminoethyl)-5-(difluoromethyl)-6-fluoro-1H-indazol-4-yl]imidazo[1,2-a]pyrazin-2-yl]formamide
CID 169196200

Frequently Asked Questions

What is the IUPAC name of N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide?
The IUPAC name of N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide (CID 163221060) is N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide.
What is the SMILES notation for N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide?
The canonical SMILES for N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide is Cc1c(F)c(C(F)(F)F)c2[nH]ncc2c1-c1ccc2nc(NC=O)cn2c1.
What is the InChIKey of N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide?
The InChIKey is KGHJQMDOOWPWAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F4N5O/c1-8-13(9-2-3-12-24-11(22-7-27)6-26(12)5-9)10-4-23-25-16(10)14(15(8)18)17(19,20)21/h2-7H,1H3,(H,22,27)(H,23,25).
What are the key properties of N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide?
N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide has a molecular weight of 377.30 g/mol, XLogP of 3.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[6-fluoro-5-methyl-7-(trifluoromethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide is sourced from PubChem (CID 163221060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).