2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide

C21H23N5O2 — CID 6187702

IUPAC2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide
SMILESC/C(=N\NC(=O)c1c(C)nc2ccccn12)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H23N5O2/c1-15(17-6-8-18(9-7-17)25-11-13-28-14-12-25)23-24-21(27)20-16(2)22-19-5-3-4-10-26(19)20/h3-10H,11-14H2,1-2H3,(H,24,27)/b23-15+
InChIKeyCTQOJGLOHNFMGE-HZHRSRAPSA-N
MW377.45 g/mol
LogP2.63
Rot. Bonds4

About 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide

2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 6187702) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID6187702
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC Name2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide
SMILESC/C(=N\NC(=O)c1c(C)nc2ccccn12)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H23N5O2/c1-15(17-6-8-18(9-7-17)25-11-13-28-14-12-25)23-24-21(27)20-16(2)22-19-5-3-4-10-26(19)20/h3-10H,11-14H2,1-2H3,(H,24,27)/b23-15+
InChIKeyCTQOJGLOHNFMGE-HZHRSRAPSA-N
XLogP2.63
TPSA71.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide (CID 6187702) is 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide is C/C(=N\NC(=O)c1c(C)nc2ccccn12)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is CTQOJGLOHNFMGE-HZHRSRAPSA-N. The full InChI is InChI=1S/C21H23N5O2/c1-15(17-6-8-18(9-7-17)25-11-13-28-14-12-25)23-24-21(27)20-16(2)22-19-5-3-4-10-26(19)20/h3-10H,11-14H2,1-2H3,(H,24,27)/b23-15+.
What are the key properties of 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide?
2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 6187702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).