N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide

C21H19N5O2 — CID 58046117

IUPACN,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide
SMILESCN(C)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1
InChIInChI=1S/C21H19N5O2/c1-25(2)21(28)14-3-5-16(6-4-14)24-17-7-8-18(26-12-11-23-20(17)26)15-9-10-22-19(27)13-15/h3-13,24H,1-2H3,(H,22,27)
InChIKeyNZPKPXJRUSXOAJ-UHFFFAOYSA-N
MW373.42 g/mol
LogP3.13
Rot. Bonds4

About N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide

N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide (PubChem CID 58046117) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide
PubChem CID58046117
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC NameN,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide
SMILESCN(C)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1
InChIInChI=1S/C21H19N5O2/c1-25(2)21(28)14-3-5-16(6-4-14)24-17-7-8-18(26-12-11-23-20(17)26)15-9-10-22-19(27)13-15/h3-13,24H,1-2H3,(H,22,27)
InChIKeyNZPKPXJRUSXOAJ-UHFFFAOYSA-N
XLogP3.13
TPSA82.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide?
The IUPAC name of N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide (CID 58046117) is N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide?
The canonical SMILES for N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide is CN(C)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.
What is the InChIKey of N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide?
The InChIKey is NZPKPXJRUSXOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-25(2)21(28)14-3-5-16(6-4-14)24-17-7-8-18(26-12-11-23-20(17)26)15-9-10-22-19(27)13-15/h3-13,24H,1-2H3,(H,22,27).
What are the key properties of N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide?
N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide has a molecular weight of 373.42 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide is sourced from PubChem (CID 58046117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).