N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

C24H23N5O4S — CID 71728281

IUPACN-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)c2ccc(N3CCOCC3)cc2)cn1)c1ccc2nccn2c1
InChIInChI=1S/C24H23N5O4S/c30-24(18-1-8-23-25-9-10-29(23)17-18)27-15-19-2-5-22(16-26-19)34(31,32)21-6-3-20(4-7-21)28-11-13-33-14-12-28/h1-10,16-17H,11-15H2,(H,27,30)
InChIKeyAVIQWXHKYIWFPK-UHFFFAOYSA-N
MW477.55 g/mol
LogP2.33
Rot. Bonds6

About N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 71728281) has the molecular formula C24H23N5O4S and a molecular weight of 477.55 g/mol. Its IUPAC name is N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID71728281
Molecular FormulaC24H23N5O4S
Molecular Weight477.55 g/mol
Exact Mass477.15
IUPAC NameN-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)c2ccc(N3CCOCC3)cc2)cn1)c1ccc2nccn2c1
InChIInChI=1S/C24H23N5O4S/c30-24(18-1-8-23-25-9-10-29(23)17-18)27-15-19-2-5-22(16-26-19)34(31,32)21-6-3-20(4-7-21)28-11-13-33-14-12-28/h1-10,16-17H,11-15H2,(H,27,30)
InChIKeyAVIQWXHKYIWFPK-UHFFFAOYSA-N
XLogP2.33
TPSA105.90 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.55
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 71728281) is N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is O=C(NCc1ccc(S(=O)(=O)c2ccc(N3CCOCC3)cc2)cn1)c1ccc2nccn2c1.
What is the InChIKey of N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is AVIQWXHKYIWFPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O4S/c30-24(18-1-8-23-25-9-10-29(23)17-18)27-15-19-2-5-22(16-26-19)34(31,32)21-6-3-20(4-7-21)28-11-13-33-14-12-28/h1-10,16-17H,11-15H2,(H,27,30).
What are the key properties of N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 477.55 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-morpholin-4-ylphenyl)sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 71728281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).