N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine

C12H17N5S — CID 106325932

IUPACN-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESc1cn2nccc2c(NCCN2CCSCC2)n1
InChIInChI=1S/C12H17N5S/c1-2-15-17-6-4-14-12(11(1)17)13-3-5-16-7-9-18-10-8-16/h1-2,4,6H,3,5,7-10H2,(H,13,14)
InChIKeyUSCNMSWIGBYLLP-UHFFFAOYSA-N
MW263.37 g/mol
LogP1.19
Rot. Bonds4

About N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine

N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 106325932) has the molecular formula C12H17N5S and a molecular weight of 263.37 g/mol. Its IUPAC name is N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID106325932
Molecular FormulaC12H17N5S
Molecular Weight263.37 g/mol
Exact Mass263.12
IUPAC NameN-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESc1cn2nccc2c(NCCN2CCSCC2)n1
InChIInChI=1S/C12H17N5S/c1-2-15-17-6-4-14-12(11(1)17)13-3-5-16-7-9-18-10-8-16/h1-2,4,6H,3,5,7-10H2,(H,13,14)
InChIKeyUSCNMSWIGBYLLP-UHFFFAOYSA-N
XLogP1.19
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine 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

Pyrazolo[1,5-a]pyrazin-4-amine
CID 57680871
N-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]pyrazolo[1,5-a]pyrazin-6-amine
CID 164559314
N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730486
N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104730750
N-(3,3,3-trifluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731421
N-(thian-2-ylmethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731910
N-(2,2-difluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731965
N-(4,4,4-trifluorobutyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731975
N-(5,5,5-trifluoropentyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731978
N-(4,4,4-trifluorobutan-2-yl)pyrazolo[1,5-a]pyrazin-4-amine
CID 105940408
N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 106215006
N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106293786

Frequently Asked Questions

What is the IUPAC name of N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine (CID 106325932) is N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine is c1cn2nccc2c(NCCN2CCSCC2)n1.
What is the InChIKey of N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is USCNMSWIGBYLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5S/c1-2-15-17-6-4-14-12(11(1)17)13-3-5-16-7-9-18-10-8-16/h1-2,4,6H,3,5,7-10H2,(H,13,14).
What are the key properties of N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine?
N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 263.37 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 106325932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).