3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide

C18H18ClFN4OS — CID 156845290

IUPAC3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3sc(C4CCNCC4)cc3Cl)cc(F)c2n1
InChIInChI=1S/C18H18ClFN4OS/c1-10-8-24-9-12(6-14(20)17(24)22-10)23-18(25)16-13(19)7-15(26-16)11-2-4-21-5-3-11/h6-9,11,21H,2-5H2,1H3,(H,23,25)
InChIKeyRPVBFYCBNPXIOL-UHFFFAOYSA-N
MW392.89 g/mol
LogP4.22
Rot. Bonds3

About 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide

3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide (PubChem CID 156845290) has the molecular formula C18H18ClFN4OS and a molecular weight of 392.89 g/mol. Its IUPAC name is 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide
PubChem CID156845290
Molecular FormulaC18H18ClFN4OS
Molecular Weight392.89 g/mol
Exact Mass392.09
IUPAC Name3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3sc(C4CCNCC4)cc3Cl)cc(F)c2n1
InChIInChI=1S/C18H18ClFN4OS/c1-10-8-24-9-12(6-14(20)17(24)22-10)23-18(25)16-13(19)7-15(26-16)11-2-4-21-5-3-11/h6-9,11,21H,2-5H2,1H3,(H,23,25)
InChIKeyRPVBFYCBNPXIOL-UHFFFAOYSA-N
XLogP4.22
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.89
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-fluoro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-(2-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 167500126
N-(2,8-dimethylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-5-(2-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 156845224
CID 156845164
CID 156845164
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[methyl(piperidin-4-yl)amino]pyrazine-2-carboxamide
CID 163683694
2-amino-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-(methyliminomethyl)-4-piperidin-4-ylbenzamide
CID 170380599
2-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrimidine-5-carboxamide
CID 166507578
3-fluoro-N-(2-methylimidazo[1,2-a]pyrazin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide
CID 156845235
3-fluoro-N-(2-methylindazol-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide
CID 156845232
tert-butyl 4-[5-[(2,8-dimethylimidazo[1,2-a]pyridin-6-yl)carbamoyl]-4-fluorothiophen-2-yl]piperidine-1-carboxylate
CID 168725199
3-fluoro-N-(4-fluoro-2-methylindazol-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide
CID 156845099
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)-7-piperazin-1-yl-2H-benzotriazole-4-carboxamide
CID 167501514

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide?
The IUPAC name of 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide (CID 156845290) is 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide?
The canonical SMILES for 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide is Cc1cn2cc(NC(=O)c3sc(C4CCNCC4)cc3Cl)cc(F)c2n1.
What is the InChIKey of 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide?
The InChIKey is RPVBFYCBNPXIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClFN4OS/c1-10-8-24-9-12(6-14(20)17(24)22-10)23-18(25)16-13(19)7-15(26-16)11-2-4-21-5-3-11/h6-9,11,21H,2-5H2,1H3,(H,23,25).
What are the key properties of 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide?
3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide has a molecular weight of 392.89 g/mol, XLogP of 4.22, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperidin-4-ylthiophene-2-carboxamide is sourced from PubChem (CID 156845290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).