2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide

C15H13FN4OS — CID 154686362

IUPAC2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide
SMILESCc1cc(-c2ccc3nc(NC(=O)C4CC4F)cn3c2)sn1
InChIInChI=1S/C15H13FN4OS/c1-8-4-12(22-19-8)9-2-3-14-17-13(7-20(14)6-9)18-15(21)10-5-11(10)16/h2-4,6-7,10-11H,5H2,1H3,(H,18,21)
InChIKeyKHVREQDZRDFIBW-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.06
Rot. Bonds3

About 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide

2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide (PubChem CID 154686362) has the molecular formula C15H13FN4OS and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide
PubChem CID154686362
Molecular FormulaC15H13FN4OS
Molecular Weight316.36 g/mol
Exact Mass316.08
IUPAC Name2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide
SMILESCc1cc(-c2ccc3nc(NC(=O)C4CC4F)cn3c2)sn1
InChIInChI=1S/C15H13FN4OS/c1-8-4-12(22-19-8)9-2-3-14-17-13(7-20(14)6-9)18-15(21)10-5-11(10)16/h2-4,6-7,10-11H,5H2,1H3,(H,18,21)
InChIKeyKHVREQDZRDFIBW-UHFFFAOYSA-N
XLogP3.06
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide?
The IUPAC name of 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide (CID 154686362) is 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide is Cc1cc(-c2ccc3nc(NC(=O)C4CC4F)cn3c2)sn1.
What is the InChIKey of 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide?
The InChIKey is KHVREQDZRDFIBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4OS/c1-8-4-12(22-19-8)9-2-3-14-17-13(7-20(14)6-9)18-15(21)10-5-11(10)16/h2-4,6-7,10-11H,5H2,1H3,(H,18,21).
What are the key properties of 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide?
2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide has a molecular weight of 316.36 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[6-(3-methyl-1,2-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 154686362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).