N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

C24H29N5O4S — CID 118160942

IUPACN-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)C2CCN(C3CCOCC3)CC2)cn1)c1ccc2nccn2c1
InChIInChI=1S/C24H29N5O4S/c30-24(18-1-4-23-25-9-12-29(23)17-18)27-15-19-2-3-22(16-26-19)34(31,32)21-5-10-28(11-6-21)20-7-13-33-14-8-20/h1-4,9,12,16-17,20-21H,5-8,10-11,13-15H2,(H,27,30)
InChIKeySSFBJLXOWQPPTG-UHFFFAOYSA-N
MW483.59 g/mol
LogP2.08
Rot. Bonds6

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

N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 118160942) has the molecular formula C24H29N5O4S and a molecular weight of 483.59 g/mol. Its IUPAC name is N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID118160942
Molecular FormulaC24H29N5O4S
Molecular Weight483.59 g/mol
Exact Mass483.19
IUPAC NameN-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)C2CCN(C3CCOCC3)CC2)cn1)c1ccc2nccn2c1
InChIInChI=1S/C24H29N5O4S/c30-24(18-1-4-23-25-9-12-29(23)17-18)27-15-19-2-3-22(16-26-19)34(31,32)21-5-10-28(11-6-21)20-7-13-33-14-8-20/h1-4,9,12,16-17,20-21H,5-8,10-11,13-15H2,(H,27,30)
InChIKeySSFBJLXOWQPPTG-UHFFFAOYSA-N
XLogP2.08
TPSA105.90 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.59
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 118160942) is N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is O=C(NCc1ccc(S(=O)(=O)C2CCN(C3CCOCC3)CC2)cn1)c1ccc2nccn2c1.
What is the InChIKey of N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is SSFBJLXOWQPPTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O4S/c30-24(18-1-4-23-25-9-12-29(23)17-18)27-15-19-2-3-22(16-26-19)34(31,32)21-5-10-28(11-6-21)20-7-13-33-14-8-20/h1-4,9,12,16-17,20-21H,5-8,10-11,13-15H2,(H,27,30).
What are the key properties of N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 483.59 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[1-(oxan-4-yl)piperidin-4-yl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 118160942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).