1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one

C18H20N4O3S — CID 4786108

IUPAC1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one
SMILESCc1ccc2nc(Cn3cc(S(=O)(=O)N4CCCC4)ccc3=O)cn2c1
InChIInChI=1S/C18H20N4O3S/c1-14-4-6-17-19-15(11-20(17)10-14)12-21-13-16(5-7-18(21)23)26(24,25)22-8-2-3-9-22/h4-7,10-11,13H,2-3,8-9,12H2,1H3
InChIKeyNZGACQNMTJRTBW-UHFFFAOYSA-N
MW372.45 g/mol
LogP1.64
Rot. Bonds4

About 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one

1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one (PubChem CID 4786108) has the molecular formula C18H20N4O3S and a molecular weight of 372.45 g/mol. Its IUPAC name is 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one.

Molecular Properties

Compound Name1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one
PubChem CID4786108
Molecular FormulaC18H20N4O3S
Molecular Weight372.45 g/mol
Exact Mass372.13
IUPAC Name1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one
SMILESCc1ccc2nc(Cn3cc(S(=O)(=O)N4CCCC4)ccc3=O)cn2c1
InChIInChI=1S/C18H20N4O3S/c1-14-4-6-17-19-15(11-20(17)10-14)12-21-13-16(5-7-18(21)23)26(24,25)22-8-2-3-9-22/h4-7,10-11,13H,2-3,8-9,12H2,1H3
InChIKeyNZGACQNMTJRTBW-UHFFFAOYSA-N
XLogP1.64
TPSA76.68 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one?
The IUPAC name of 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one (CID 4786108) is 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one.
What is the SMILES notation for 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one?
The canonical SMILES for 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one is Cc1ccc2nc(Cn3cc(S(=O)(=O)N4CCCC4)ccc3=O)cn2c1.
What is the InChIKey of 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one?
The InChIKey is NZGACQNMTJRTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3S/c1-14-4-6-17-19-15(11-20(17)10-14)12-21-13-16(5-7-18(21)23)26(24,25)22-8-2-3-9-22/h4-7,10-11,13H,2-3,8-9,12H2,1H3.
What are the key properties of 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one?
1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one has a molecular weight of 372.45 g/mol, XLogP of 1.64, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-one is sourced from PubChem (CID 4786108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).