5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine

C15H18N6O2S — CID 42306412

IUPAC5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
SMILESCC[C@H](Nc1nc2nonc2nc1N1CCOCC1)c1cccs1
InChIInChI=1S/C15H18N6O2S/c1-2-10(11-4-3-9-24-11)16-14-15(21-5-7-22-8-6-21)18-13-12(17-14)19-23-20-13/h3-4,9-10H,2,5-8H2,1H3,(H,16,17,19)/t10-/m0/s1
InChIKeyPGZMMIBNWTXSHD-JTQLQIEISA-N
MW346.42 g/mol
LogP2.47
Rot. Bonds5

About 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine

5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine (PubChem CID 42306412) has the molecular formula C15H18N6O2S and a molecular weight of 346.42 g/mol. Its IUPAC name is 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine.

Molecular Properties

Compound Name5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
PubChem CID42306412
Molecular FormulaC15H18N6O2S
Molecular Weight346.42 g/mol
Exact Mass346.12
IUPAC Name5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
SMILESCC[C@H](Nc1nc2nonc2nc1N1CCOCC1)c1cccs1
InChIInChI=1S/C15H18N6O2S/c1-2-10(11-4-3-9-24-11)16-14-15(21-5-7-22-8-6-21)18-13-12(17-14)19-23-20-13/h3-4,9-10H,2,5-8H2,1H3,(H,16,17,19)/t10-/m0/s1
InChIKeyPGZMMIBNWTXSHD-JTQLQIEISA-N
XLogP2.47
TPSA89.20 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.42
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-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

1-[1-[6-(thiophen-2-ylmethylamino)-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]piperidin-4-yl]propan-1-ol
CID 45173518
(1S)-1-[1-[6-(thiophen-2-ylmethylamino)-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]piperidin-4-yl]propan-1-ol
CID 42189859
N-(1-thiophen-2-ylpropyl)morpholine-4-sulfonamide
CID 47306222
N-(1-thiophen-2-ylpropyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 19771561
N-[(1S)-1-phenylethyl]-5-pyrrolidin-1-yl-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
CID 671936
4-N-(1-thiophen-2-ylpropyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine-2,4-diamine;dihydrochloride
CID 154885577
6-hydrazinyl-2,5-dimethyl-N-(1-thiophen-2-ylpropyl)pyrimidin-4-amine
CID 80896820
2-(1-thiophen-2-ylpropylamino)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
CID 62710326
1,3,5-trimethyl-N-(1-thiophen-2-ylpropyl)pyrazol-4-amine
CID 43204555
3-pyrrolidin-1-yl-N-(1-thiophen-2-ylpropyl)aniline
CID 60943707
3-(1-thiophen-2-ylpropylamino)pyridazine-4-carbonitrile
CID 80510343
2,3-dimethyl-5-nitro-N-(1-thiophen-2-ylpropyl)imidazol-4-amine
CID 103554809

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
The IUPAC name of 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine (CID 42306412) is 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine.
What is the SMILES notation for 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
The canonical SMILES for 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine is CC[C@H](Nc1nc2nonc2nc1N1CCOCC1)c1cccs1.
What is the InChIKey of 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
The InChIKey is PGZMMIBNWTXSHD-JTQLQIEISA-N. The full InChI is InChI=1S/C15H18N6O2S/c1-2-10(11-4-3-9-24-11)16-14-15(21-5-7-22-8-6-21)18-13-12(17-14)19-23-20-13/h3-4,9-10H,2,5-8H2,1H3,(H,16,17,19)/t10-/m0/s1.
What are the key properties of 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine has a molecular weight of 346.42 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-N-[(1S)-1-thiophen-2-ylpropyl]-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine is sourced from PubChem (CID 42306412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).