N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide

C20H23N5O2S — CID 91908347

IUPACN-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc3c(N4CCSCC4)nc(C)cn3n2)cc1
InChIInChI=1S/C20H23N5O2S/c1-3-27-16-6-4-15(5-7-16)22-20(26)17-12-18-19(24-8-10-28-11-9-24)21-14(2)13-25(18)23-17/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,26)
InChIKeyUBOYBTXGJTXUSV-UHFFFAOYSA-N
MW397.50 g/mol
LogP3.24
Rot. Bonds5

About N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide

N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide (PubChem CID 91908347) has the molecular formula C20H23N5O2S and a molecular weight of 397.50 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide
PubChem CID91908347
Molecular FormulaC20H23N5O2S
Molecular Weight397.50 g/mol
Exact Mass397.16
IUPAC NameN-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc3c(N4CCSCC4)nc(C)cn3n2)cc1
InChIInChI=1S/C20H23N5O2S/c1-3-27-16-6-4-15(5-7-16)22-20(26)17-12-18-19(24-8-10-28-11-9-24)21-14(2)13-25(18)23-17/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,26)
InChIKeyUBOYBTXGJTXUSV-UHFFFAOYSA-N
XLogP3.24
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.50
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-N-(4-ethoxyphenyl)-2-thiomorpholin-4-ylpyrimidine-5-carboxamide
CID 53144022
N-(4-ethoxyphenyl)pyrazolo[1,5-a]pyridine-2-carboxamide
CID 51408989
N-cyclopentyl-6-methyl-4-pyrrolidin-1-ylpyrazolo[1,5-a]pyrazine-2-carboxamide
CID 91891274
N-(4-ethoxyphenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365450
6-N-(3,4-dimethylphenyl)-2-N-(4-ethoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100441
N-(4-ethoxyphenyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204671
1-(4-ethoxyphenyl)-1-ethyl-3-(4-thiomorpholin-4-ylphenyl)urea
CID 154759649
N-(4-ethoxyphenyl)-2-methylsulfanyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide
CID 8707434
1-(4-ethoxyphenyl)-3-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]urea
CID 122352293
6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(4-ethoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 109372888
5-(cyclopentanecarbonylamino)-N-(4-ethoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 51999549
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 2115172

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide (CID 91908347) is N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide is CCOc1ccc(NC(=O)c2cc3c(N4CCSCC4)nc(C)cn3n2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide?
The InChIKey is UBOYBTXGJTXUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2S/c1-3-27-16-6-4-15(5-7-16)22-20(26)17-12-18-19(24-8-10-28-11-9-24)21-14(2)13-25(18)23-17/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,26).
What are the key properties of N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide?
N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide has a molecular weight of 397.50 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-6-methyl-4-thiomorpholin-4-ylpyrazolo[1,5-a]pyrazine-2-carboxamide is sourced from PubChem (CID 91908347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).