N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide

C22H17N5O5 — CID 167857754

IUPACN-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide
SMILESCc1cn2ccc(C(=O)Nc3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)cc2n1
InChIInChI=1S/C22H17N5O5/c1-11-10-26-7-6-12(8-17(26)23-11)19(29)24-13-2-3-14-15(9-13)22(32)27(21(14)31)16-4-5-18(28)25-20(16)30/h2-3,6-10,16H,4-5H2,1H3,(H,24,29)(H,25,28,30)
InChIKeyQLQCQJOPQVROPW-UHFFFAOYSA-N
MW431.41 g/mol
LogP1.30
Rot. Bonds3

About N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide

N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide (PubChem CID 167857754) has the molecular formula C22H17N5O5 and a molecular weight of 431.41 g/mol. Its IUPAC name is N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide
PubChem CID167857754
Molecular FormulaC22H17N5O5
Molecular Weight431.41 g/mol
Exact Mass431.12
IUPAC NameN-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide
SMILESCc1cn2ccc(C(=O)Nc3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)cc2n1
InChIInChI=1S/C22H17N5O5/c1-11-10-26-7-6-12(8-17(26)23-11)19(29)24-13-2-3-14-15(9-13)22(32)27(21(14)31)16-4-5-18(28)25-20(16)30/h2-3,6-10,16H,4-5H2,1H3,(H,24,29)(H,25,28,30)
InChIKeyQLQCQJOPQVROPW-UHFFFAOYSA-N
XLogP1.30
TPSA129.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.41
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

2,5-dibromo-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-1H-imidazole-4-carboxamide
CID 177187881
N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]butanamide
CID 163906697
N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]prop-2-enamide
CID 121448709
aniline;N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]acetamide
CID 159636176
2-(2,6-dioxopiperidin-3-yl)-5-(methylamino)isoindole-1,3-dione;ethane
CID 166535785
N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-4-(piperazin-1-ylmethyl)benzamide
CID 170980218
methyl 4-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]carbamoyl]cubane-1-carboxylate
CID 171393695
1-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-3-[2-[4-(6-methyl-3-pyridinyl)phenyl]propan-2-yl]urea
CID 176565048
2-(2,6-dioxopiperidin-3-yl)-5-methylisoindole-1,3-dione;ethane
CID 142365131
2-(2-chlorophenyl)-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylpropanamide
CID 166426870
1-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-3-[2-(3-methylphenyl)propan-2-yl]urea
CID 176565051
2-(2,6-dioxopiperidin-3-yl)-N-(2-methylprop-2-enyl)-1,3-dioxoisoindole-5-carboxamide
CID 166426897

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide?
The IUPAC name of N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide (CID 167857754) is N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide?
The canonical SMILES for N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide is Cc1cn2ccc(C(=O)Nc3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)cc2n1.
What is the InChIKey of N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide?
The InChIKey is QLQCQJOPQVROPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O5/c1-11-10-26-7-6-12(8-17(26)23-11)19(29)24-13-2-3-14-15(9-13)22(32)27(21(14)31)16-4-5-18(28)25-20(16)30/h2-3,6-10,16H,4-5H2,1H3,(H,24,29)(H,25,28,30).
What are the key properties of N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide?
N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide has a molecular weight of 431.41 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxamide is sourced from PubChem (CID 167857754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).