7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

C15H18N4O4S — CID 134791404

IUPAC7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCNC(=O)c1cn2c(n1)CN(S(=O)(=O)c1cccc(OC)c1)CC2
InChIInChI=1S/C15H18N4O4S/c1-16-15(20)13-9-18-6-7-19(10-14(18)17-13)24(21,22)12-5-3-4-11(8-12)23-2/h3-5,8-9H,6-7,10H2,1-2H3,(H,16,20)
InChIKeyJZQUBSGFQPESDE-UHFFFAOYSA-N
MW350.40 g/mol
LogP0.46
Rot. Bonds4

About 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 134791404) has the molecular formula C15H18N4O4S and a molecular weight of 350.40 g/mol. Its IUPAC name is 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID134791404
Molecular FormulaC15H18N4O4S
Molecular Weight350.40 g/mol
Exact Mass350.10
IUPAC Name7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCNC(=O)c1cn2c(n1)CN(S(=O)(=O)c1cccc(OC)c1)CC2
InChIInChI=1S/C15H18N4O4S/c1-16-15(20)13-9-18-6-7-19(10-14(18)17-13)24(21,22)12-5-3-4-11(8-12)23-2/h3-5,8-9H,6-7,10H2,1-2H3,(H,16,20)
InChIKeyJZQUBSGFQPESDE-UHFFFAOYSA-N
XLogP0.46
TPSA93.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (CID 134791404) is 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is CNC(=O)c1cn2c(n1)CN(S(=O)(=O)c1cccc(OC)c1)CC2.
What is the InChIKey of 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is JZQUBSGFQPESDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O4S/c1-16-15(20)13-9-18-6-7-19(10-14(18)17-13)24(21,22)12-5-3-4-11(8-12)23-2/h3-5,8-9H,6-7,10H2,1-2H3,(H,16,20).
What are the key properties of 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 350.40 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-methoxyphenyl)sulfonyl-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 134791404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).