6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide

C40H34N10O3 — CID 122478423

IUPAC6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCC(C)c1cccc(-c2ncccc2-c2ccc3ncc(C(N)=O)n3c2)n1.COc1cccc(-c2ncccc2-c2ccc3ncc(C(N)=O)n3c2)n1
InChIInChI=1S/C21H19N5O.C19H15N5O2/c1-13(2)16-6-3-7-17(25-16)20-15(5-4-10-23-20)14-8-9-19-24-11-18(21(22)27)26(19)12-14;1-26-17-6-2-5-14(23-17)18-13(4-3-9-21-18)12-7-8-16-22-10-15(19(20)25)24(16)11-12/h3-13H,1-2H3,(H2,22,27);2-11H,1H3,(H2,20,25)
InChIKeyVAFGSEKQYCRSQF-UHFFFAOYSA-N
MW702.78 g/mol
LogP6.25
Rot. Bonds8

About 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide

6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 122478423) has the molecular formula C40H34N10O3 and a molecular weight of 702.78 g/mol. Its IUPAC name is 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID122478423
Molecular FormulaC40H34N10O3
Molecular Weight702.78 g/mol
Exact Mass702.28
IUPAC Name6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCC(C)c1cccc(-c2ncccc2-c2ccc3ncc(C(N)=O)n3c2)n1.COc1cccc(-c2ncccc2-c2ccc3ncc(C(N)=O)n3c2)n1
InChIInChI=1S/C21H19N5O.C19H15N5O2/c1-13(2)16-6-3-7-17(25-16)20-15(5-4-10-23-20)14-8-9-19-24-11-18(21(22)27)26(19)12-14;1-26-17-6-2-5-14(23-17)18-13(4-3-9-21-18)12-7-8-16-22-10-15(19(20)25)24(16)11-12/h3-13H,1-2H3,(H2,22,27);2-11H,1H3,(H2,20,25)
InChIKeyVAFGSEKQYCRSQF-UHFFFAOYSA-N
XLogP6.25
TPSA181.57 Ų
H-Bond Donors2
H-Bond Acceptors11
Rotatable Bonds8
Heavy Atoms53
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500702.78
LogP ≤ 56.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1011

Analyze 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 122478423) is 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide is CC(C)c1cccc(-c2ncccc2-c2ccc3ncc(C(N)=O)n3c2)n1.COc1cccc(-c2ncccc2-c2ccc3ncc(C(N)=O)n3c2)n1.
What is the InChIKey of 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is VAFGSEKQYCRSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O.C19H15N5O2/c1-13(2)16-6-3-7-17(25-16)20-15(5-4-10-23-20)14-8-9-19-24-11-18(21(22)27)26(19)12-14;1-26-17-6-2-5-14(23-17)18-13(4-3-9-21-18)12-7-8-16-22-10-15(19(20)25)24(16)11-12/h3-13H,1-2H3,(H2,22,27);2-11H,1H3,(H2,20,25).
What are the key properties of 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 702.78 g/mol, XLogP of 6.25, 8 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(6-propan-2-yl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 122478423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).