6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide

C19H12F3N5O — CID 122478437

IUPAC6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(-c3cc(F)cnc3-c3cccc(C(F)F)n3)cn12
InChIInChI=1S/C19H12F3N5O/c20-11-6-12(10-4-5-16-24-8-15(19(23)28)27(16)9-10)17(25-7-11)13-2-1-3-14(26-13)18(21)22/h1-9,18H,(H2,23,28)
InChIKeyYKRXQSOZJKVUAG-UHFFFAOYSA-N
MW383.33 g/mol
LogP3.63
Rot. Bonds4

About 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide

6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 122478437) has the molecular formula C19H12F3N5O and a molecular weight of 383.33 g/mol. Its IUPAC name is 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID122478437
Molecular FormulaC19H12F3N5O
Molecular Weight383.33 g/mol
Exact Mass383.10
IUPAC Name6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(-c3cc(F)cnc3-c3cccc(C(F)F)n3)cn12
InChIInChI=1S/C19H12F3N5O/c20-11-6-12(10-4-5-16-24-8-15(19(23)28)27(16)9-10)17(25-7-11)13-2-1-3-14(26-13)18(21)22/h1-9,18H,(H2,23,28)
InChIKeyYKRXQSOZJKVUAG-UHFFFAOYSA-N
XLogP3.63
TPSA86.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.33
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 122478437) is 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide is NC(=O)c1cnc2ccc(-c3cc(F)cnc3-c3cccc(C(F)F)n3)cn12.
What is the InChIKey of 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is YKRXQSOZJKVUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N5O/c20-11-6-12(10-4-5-16-24-8-15(19(23)28)27(16)9-10)17(25-7-11)13-2-1-3-14(26-13)18(21)22/h1-9,18H,(H2,23,28).
What are the key properties of 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 383.33 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[6-(difluoromethyl)-2-pyridinyl]-5-fluoro-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 122478437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).