N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide

C18H18N8O — CID 62706814

IUPACN-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide
SMILESCC(=O)Nc1cc(-c2c(Nc3ccn(C)n3)nc3ccccn23)nc(C)n1
InChIInChI=1S/C18H18N8O/c1-11-19-13(10-15(20-11)21-12(2)27)17-18(22-14-7-9-25(3)24-14)23-16-6-4-5-8-26(16)17/h4-10H,1-3H3,(H,22,24)(H,19,20,21,27)
InChIKeyUVYODFKMMWFOEC-UHFFFAOYSA-N
MW362.40 g/mol
LogP2.54
Rot. Bonds4

About N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide

N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide (PubChem CID 62706814) has the molecular formula C18H18N8O and a molecular weight of 362.40 g/mol. Its IUPAC name is N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide
PubChem CID62706814
Molecular FormulaC18H18N8O
Molecular Weight362.40 g/mol
Exact Mass362.16
IUPAC NameN-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide
SMILESCC(=O)Nc1cc(-c2c(Nc3ccn(C)n3)nc3ccccn23)nc(C)n1
InChIInChI=1S/C18H18N8O/c1-11-19-13(10-15(20-11)21-12(2)27)17-18(22-14-7-9-25(3)24-14)23-16-6-4-5-8-26(16)17/h4-10H,1-3H3,(H,22,24)(H,19,20,21,27)
InChIKeyUVYODFKMMWFOEC-UHFFFAOYSA-N
XLogP2.54
TPSA102.03 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide?
The IUPAC name of N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide (CID 62706814) is N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide.
What is the SMILES notation for N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide?
The canonical SMILES for N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide is CC(=O)Nc1cc(-c2c(Nc3ccn(C)n3)nc3ccccn23)nc(C)n1.
What is the InChIKey of N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide?
The InChIKey is UVYODFKMMWFOEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N8O/c1-11-19-13(10-15(20-11)21-12(2)27)17-18(22-14-7-9-25(3)24-14)23-16-6-4-5-8-26(16)17/h4-10H,1-3H3,(H,22,24)(H,19,20,21,27).
What are the key properties of N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide?
N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide has a molecular weight of 362.40 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]acetamide is sourced from PubChem (CID 62706814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).