N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide

C22H21FN6OS — CID 177202636

IUPACN-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3cc4ccc(N5C[C@H]6CN(C)C[C@H]65)nc4s3)cc(F)c2n1
InChIInChI=1S/C22H21FN6OS/c1-12-7-28-10-15(6-16(23)20(28)24-12)25-21(30)18-5-13-3-4-19(26-22(13)31-18)29-9-14-8-27(2)11-17(14)29/h3-7,10,14,17H,8-9,11H2,1-2H3,(H,25,30)/t14-,17-/m1/s1
InChIKeyNYJGZZWOISWVKN-RHSMWYFYSA-N
MW436.52 g/mol
LogP3.39
Rot. Bonds3

About N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide

N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 177202636) has the molecular formula C22H21FN6OS and a molecular weight of 436.52 g/mol. Its IUPAC name is N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID177202636
Molecular FormulaC22H21FN6OS
Molecular Weight436.52 g/mol
Exact Mass436.15
IUPAC NameN-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3cc4ccc(N5C[C@H]6CN(C)C[C@H]65)nc4s3)cc(F)c2n1
InChIInChI=1S/C22H21FN6OS/c1-12-7-28-10-15(6-16(23)20(28)24-12)25-21(30)18-5-13-3-4-19(26-22(13)31-18)29-9-14-8-27(2)11-17(14)29/h3-7,10,14,17H,8-9,11H2,1-2H3,(H,25,30)/t14-,17-/m1/s1
InChIKeyNYJGZZWOISWVKN-RHSMWYFYSA-N
XLogP3.39
TPSA65.77 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.52
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide with MolForge

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Related Compounds

8-fluoro-N,2-dimethylimidazo[1,2-a]pyridin-6-amine;3-(3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl)thieno[2,3-b]pyrazine-6-carbaldehyde
CID 170747497
2-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrimidine-5-carboxamide
CID 166507578
CID 156845164
CID 156845164
5-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide
CID 170747701
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-(1-methylpyrrolidin-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide
CID 170747778
6-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 177202673
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-(1,2,3,6-tetrahydropyridin-4-yl)thieno[2,3-b]pyrazine-6-carboxamide
CID 170747541
5-(2-cyclopropyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carboxamide
CID 166507512
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-pyrrolidin-1-ylpyrimidine-5-carboxamide
CID 166848134
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 166848042
4-amino-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole-5-carboxamide
CID 156888612
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[3-[(2S)-piperidin-2-yl]azetidin-1-yl]pyrazine-2-carboxamide
CID 167528526

Frequently Asked Questions

What is the IUPAC name of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide (CID 177202636) is N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide is Cc1cn2cc(NC(=O)c3cc4ccc(N5C[C@H]6CN(C)C[C@H]65)nc4s3)cc(F)c2n1.
What is the InChIKey of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is NYJGZZWOISWVKN-RHSMWYFYSA-N. The full InChI is InChI=1S/C22H21FN6OS/c1-12-7-28-10-15(6-16(23)20(28)24-12)25-21(30)18-5-13-3-4-19(26-22(13)31-18)29-9-14-8-27(2)11-17(14)29/h3-7,10,14,17H,8-9,11H2,1-2H3,(H,25,30)/t14-,17-/m1/s1.
What are the key properties of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide?
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 436.52 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(1R,5S)-3-methyl-3,6-diazabicyclo[3.2.0]heptan-6-yl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 177202636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).