6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide

C23H24FN5O2S — CID 170747428

IUPAC6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3cc4ccc(OC5CC(C)N[C@H](C)C5)nc4s3)cc(F)c2n1
InChIInChI=1S/C23H24FN5O2S/c1-12-6-17(7-13(2)25-12)31-20-5-4-15-8-19(32-23(15)28-20)22(30)27-16-9-18(24)21-26-14(3)10-29(21)11-16/h4-5,8-13,17,25H,6-7H2,1-3H3,(H,27,30)/t12-,13?,17?/m1/s1
InChIKeyXDKKZJIFJYALRS-SFYCDEOASA-N
MW453.54 g/mol
LogP4.55
Rot. Bonds4

About 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide

6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 170747428) has the molecular formula C23H24FN5O2S and a molecular weight of 453.54 g/mol. Its IUPAC name is 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID170747428
Molecular FormulaC23H24FN5O2S
Molecular Weight453.54 g/mol
Exact Mass453.16
IUPAC Name6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3cc4ccc(OC5CC(C)N[C@H](C)C5)nc4s3)cc(F)c2n1
InChIInChI=1S/C23H24FN5O2S/c1-12-6-17(7-13(2)25-12)31-20-5-4-15-8-19(32-23(15)28-20)22(30)27-16-9-18(24)21-26-14(3)10-29(21)11-16/h4-5,8-13,17,25H,6-7H2,1-3H3,(H,27,30)/t12-,13?,17?/m1/s1
InChIKeyXDKKZJIFJYALRS-SFYCDEOASA-N
XLogP4.55
TPSA80.55 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.54
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide with MolForge

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Related Compounds

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CID 25093428
N-[[3-fluoro-4-[2-(1-methylimidazol-2-yl)thieno[2,3-b]pyridin-4-yl]oxyphenyl]carbamothioyl]-2-phenylacetamide
CID 127041351
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CID 45271099
(R)-3-(1-(4-((tert-butylamino)methyl)-2-methylphenyl)ethoxy)-5-(imidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
CID 45273767
(R)-3-(1-(4-((tert-butylamino)methyl)-2-fluorophenyl)ethoxy)-5-(imidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
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2,6-difluoro-N-[[5-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-2-pyridinyl]carbamoyl]benzamide
CID 56661467
N-(3-(Dimethylamino)propyl)-4-(2-isopropoxypyridin-3-ylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide
CID 46182085
4-(2-(Tetrahydro-2H-pyran-4-yloxy)-6-(trifluoromethyl)pyridin-3-ylamino)-N-(3-(dimethylamino)propyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
CID 46182175
5-methyl-N-(morpholin-3-ylmethyl)-4-[(2-propan-2-yloxy-3-pyridinyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide
CID 58413259
N-[3-(dimethylamino)propyl]-5-methyl-4-[[2-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-yl]amino]thieno[2,3-d]pyrimidine-6-carboxamide
CID 58413273
4-[[2-(4-aminobutan-2-yloxy)-3-pyridinyl]amino]-N-[3-(dimethylamino)propyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
CID 58413314
5-methyl-N-(1-methylpiperidin-4-yl)-4-[(2-propan-2-yloxy-3-pyridinyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide
CID 58413325

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide (CID 170747428) is 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide is Cc1cn2cc(NC(=O)c3cc4ccc(OC5CC(C)N[C@H](C)C5)nc4s3)cc(F)c2n1.
What is the InChIKey of 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is XDKKZJIFJYALRS-SFYCDEOASA-N. The full InChI is InChI=1S/C23H24FN5O2S/c1-12-6-17(7-13(2)25-12)31-20-5-4-15-8-19(32-23(15)28-20)22(30)27-16-9-18(24)21-26-14(3)10-29(21)11-16/h4-5,8-13,17,25H,6-7H2,1-3H3,(H,27,30)/t12-,13?,17?/m1/s1.
What are the key properties of 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide?
6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 453.54 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-2,6-dimethylpiperidin-4-yl]oxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 170747428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).