2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

C23H27ClN4O2 — CID 121309674

IUPAC2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCCN(CC)C(=O)c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1
InChIInChI=1S/C23H27ClN4O2/c1-3-27(4-2)23(29)18-7-10-21-25-22(17-5-8-19(24)9-6-17)20(28(21)15-18)16-26-11-13-30-14-12-26/h5-10,15H,3-4,11-14,16H2,1-2H3
InChIKeySUOAVLWSWBBIOE-UHFFFAOYSA-N
MW426.95 g/mol
LogP3.97
Rot. Bonds6

About 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 121309674) has the molecular formula C23H27ClN4O2 and a molecular weight of 426.95 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID121309674
Molecular FormulaC23H27ClN4O2
Molecular Weight426.95 g/mol
Exact Mass426.18
IUPAC Name2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCCN(CC)C(=O)c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1
InChIInChI=1S/C23H27ClN4O2/c1-3-27(4-2)23(29)18-7-10-21-25-22(17-5-8-19(24)9-6-17)20(28(21)15-18)16-26-11-13-30-14-12-26/h5-10,15H,3-4,11-14,16H2,1-2H3
InChIKeySUOAVLWSWBBIOE-UHFFFAOYSA-N
XLogP3.97
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.95
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 121309674) is 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is CCN(CC)C(=O)c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.
What is the InChIKey of 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is SUOAVLWSWBBIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27ClN4O2/c1-3-27(4-2)23(29)18-7-10-21-25-22(17-5-8-19(24)9-6-17)20(28(21)15-18)16-26-11-13-30-14-12-26/h5-10,15H,3-4,11-14,16H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 426.95 g/mol, XLogP of 3.97, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 121309674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).