3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide

C22H24N8O2 — CID 155209161

IUPAC3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide
SMILESCc1cnc2ccc(-c3nc(C(=O)NCC4CCCN4C)c(N)nc3-c3ncco3)cn12
InChIInChI=1S/C22H24N8O2/c1-13-10-25-16-6-5-14(12-30(13)16)17-18(22-24-7-9-32-22)28-20(23)19(27-17)21(31)26-11-15-4-3-8-29(15)2/h5-7,9-10,12,15H,3-4,8,11H2,1-2H3,(H2,23,28)(H,26,31)
InChIKeyQLTDCHMTYUDVQH-UHFFFAOYSA-N
MW432.49 g/mol
LogP2.16
Rot. Bonds5

About 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide

3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide (PubChem CID 155209161) has the molecular formula C22H24N8O2 and a molecular weight of 432.49 g/mol. Its IUPAC name is 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide
PubChem CID155209161
Molecular FormulaC22H24N8O2
Molecular Weight432.49 g/mol
Exact Mass432.20
IUPAC Name3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide
SMILESCc1cnc2ccc(-c3nc(C(=O)NCC4CCCN4C)c(N)nc3-c3ncco3)cn12
InChIInChI=1S/C22H24N8O2/c1-13-10-25-16-6-5-14(12-30(13)16)17-18(22-24-7-9-32-22)28-20(23)19(27-17)21(31)26-11-15-4-3-8-29(15)2/h5-7,9-10,12,15H,3-4,8,11H2,1-2H3,(H2,23,28)(H,26,31)
InChIKeyQLTDCHMTYUDVQH-UHFFFAOYSA-N
XLogP2.16
TPSA127.47 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.49
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide?
The IUPAC name of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide (CID 155209161) is 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide is Cc1cnc2ccc(-c3nc(C(=O)NCC4CCCN4C)c(N)nc3-c3ncco3)cn12.
What is the InChIKey of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide?
The InChIKey is QLTDCHMTYUDVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N8O2/c1-13-10-25-16-6-5-14(12-30(13)16)17-18(22-24-7-9-32-22)28-20(23)19(27-17)21(31)26-11-15-4-3-8-29(15)2/h5-7,9-10,12,15H,3-4,8,11H2,1-2H3,(H2,23,28)(H,26,31).
What are the key properties of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide?
3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide has a molecular weight of 432.49 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(1,3-oxazol-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 155209161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).