2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide

C26H25N7O — CID 55596662

IUPAC2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCc1cc(C)nc(-n2nc(C)c(CC(=O)Nc3c(-c4ccccc4)nc4ccccn34)c2C)n1
InChIInChI=1S/C26H25N7O/c1-16-14-17(2)28-26(27-16)33-19(4)21(18(3)31-33)15-23(34)30-25-24(20-10-6-5-7-11-20)29-22-12-8-9-13-32(22)25/h5-14H,15H2,1-4H3,(H,30,34)
InChIKeyWAVIVNUJFWHHGZ-UHFFFAOYSA-N
MW451.53 g/mol
LogP4.39
Rot. Bonds5

About 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide

2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide (PubChem CID 55596662) has the molecular formula C26H25N7O and a molecular weight of 451.53 g/mol. Its IUPAC name is 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
PubChem CID55596662
Molecular FormulaC26H25N7O
Molecular Weight451.53 g/mol
Exact Mass451.21
IUPAC Name2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCc1cc(C)nc(-n2nc(C)c(CC(=O)Nc3c(-c4ccccc4)nc4ccccn34)c2C)n1
InChIInChI=1S/C26H25N7O/c1-16-14-17(2)28-26(27-16)33-19(4)21(18(3)31-33)15-23(34)30-25-24(20-10-6-5-7-11-20)29-22-12-8-9-13-32(22)25/h5-14H,15H2,1-4H3,(H,30,34)
InChIKeyWAVIVNUJFWHHGZ-UHFFFAOYSA-N
XLogP4.39
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.53
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(4-methylsulfanyl-1-phenylpyrazol-5-yl)acetamide
CID 71854348
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 112795092
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pentanamide
CID 3828486
N-[3-(benzenesulfonamido)phenyl]-2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]acetamide
CID 55705965
4-[[2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]acetyl]amino]-N-ethylbenzamide
CID 55802217
2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylsulfanylethyl)acetamide
CID 31908104
2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-[(1R,2S)-2-phenylcyclopropyl]acetamide
CID 95191625
2-[[2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]acetyl]amino]-N-propan-2-ylbenzamide
CID 55672775
4-[(2-naphthalen-2-ylimidazo[1,2-a]pyridin-3-yl)amino]-4-oxobutanoic acid
CID 23735799
7-methyl-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 17433700
2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-[3-(methanesulfonamido)phenyl]acetamide
CID 30854735
2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide
CID 55766189

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
The IUPAC name of 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide (CID 55596662) is 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
The canonical SMILES for 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide is Cc1cc(C)nc(-n2nc(C)c(CC(=O)Nc3c(-c4ccccc4)nc4ccccn34)c2C)n1.
What is the InChIKey of 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
The InChIKey is WAVIVNUJFWHHGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N7O/c1-16-14-17(2)28-26(27-16)33-19(4)21(18(3)31-33)15-23(34)30-25-24(20-10-6-5-7-11-20)29-22-12-8-9-13-32(22)25/h5-14H,15H2,1-4H3,(H,30,34).
What are the key properties of 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide has a molecular weight of 451.53 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide is sourced from PubChem (CID 55596662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).