8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

C18H19FN4O2S — CID 166315696

IUPAC8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOCc1cn2cc(C(=O)NCC3NCCc4sccc43)cc(F)c2n1
InChIInChI=1S/C18H19FN4O2S/c1-25-10-12-9-23-8-11(6-14(19)17(23)22-12)18(24)21-7-15-13-3-5-26-16(13)2-4-20-15/h3,5-6,8-9,15,20H,2,4,7,10H2,1H3,(H,21,24)
InChIKeySOEMJCGQHVKMPX-UHFFFAOYSA-N
MW374.44 g/mol
LogP2.30
Rot. Bonds5

About 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 166315696) has the molecular formula C18H19FN4O2S and a molecular weight of 374.44 g/mol. Its IUPAC name is 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID166315696
Molecular FormulaC18H19FN4O2S
Molecular Weight374.44 g/mol
Exact Mass374.12
IUPAC Name8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOCc1cn2cc(C(=O)NCC3NCCc4sccc43)cc(F)c2n1
InChIInChI=1S/C18H19FN4O2S/c1-25-10-12-9-23-8-11(6-14(19)17(23)22-12)18(24)21-7-15-13-3-5-26-16(13)2-4-20-15/h3,5-6,8-9,15,20H,2,4,7,10H2,1H3,(H,21,24)
InChIKeySOEMJCGQHVKMPX-UHFFFAOYSA-N
XLogP2.30
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide with MolForge

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Related Compounds

4-[8-(4-Morpholin-4-ylanilino)imidazo[1,2-a]pyrazin-5-yl]thiophene-2-carboxamide
CID 57399216
N-[(1R,6S)-6-amino-2,2-difluorocyclohexyl]-4-imidazo[1,2-a]pyridin-3-ylthiophene-2-carboxamide
CID 67123042
US9776991, Example 15
CID 118112602
N-((7-methylimidazo[1,2-a]pyridin-2-yl)methyl)thiophene-2-carboxamide
CID 7150712
2-ethyl-3-[methyl(1,3-thiazol-2-ylmethyl)amino]-N-(2-pyridin-2-ylethyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 46942984
N-(1-benzylpiperidin-4-yl)-2-ethyl-3-[methyl(thiophen-2-ylmethyl)amino]imidazo[1,2-a]pyridine-6-carboxamide
CID 46948410
2-ethyl-N-[2-(4-methoxyphenoxy)ethyl]-3-[methyl(thiophen-2-ylmethyl)amino]imidazo[1,2-a]pyridine-6-carboxamide
CID 46948440
N-(4-(4-(4-fluorophenyl)-1-(2-methoxyethyl)-2-(methylthio)-1H-imidazol-5-yl)pyridin-2-yl)thiophene-2-carboxamide
CID 52948905
N-(2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl)thiophene-2-carboxamide
CID 7150757
N-(piperidin-2-ylmethyl)-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 49855877
N-[(3S)-piperidin-3-yl]-2-(thiophen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 49857405
N-[[5-[1-(2-methylpropyl)piperidin-4-yl]sulfinyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 118160929

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 166315696) is 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is COCc1cn2cc(C(=O)NCC3NCCc4sccc43)cc(F)c2n1.
What is the InChIKey of 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is SOEMJCGQHVKMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4O2S/c1-25-10-12-9-23-8-11(6-14(19)17(23)22-12)18(24)21-7-15-13-3-5-26-16(13)2-4-20-15/h3,5-6,8-9,15,20H,2,4,7,10H2,1H3,(H,21,24).
What are the key properties of 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-(methoxymethyl)-N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 166315696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).