3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine

C11H21N5OS — CID 125446673

IUPAC3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine
SMILESC[C@H](CN1CCOCC1)Nc1nc(N(C)C)ns1
InChIInChI=1S/C11H21N5OS/c1-9(8-16-4-6-17-7-5-16)12-11-13-10(14-18-11)15(2)3/h9H,4-8H2,1-3H3,(H,12,13,14)/t9-/m1/s1
InChIKeyADIJUMRWJXSWLV-SECBINFHSA-N
MW271.39 g/mol
LogP0.74
Rot. Bonds5

About 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine

3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine (PubChem CID 125446673) has the molecular formula C11H21N5OS and a molecular weight of 271.39 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine
PubChem CID125446673
Molecular FormulaC11H21N5OS
Molecular Weight271.39 g/mol
Exact Mass271.15
IUPAC Name3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine
SMILESC[C@H](CN1CCOCC1)Nc1nc(N(C)C)ns1
InChIInChI=1S/C11H21N5OS/c1-9(8-16-4-6-17-7-5-16)12-11-13-10(14-18-11)15(2)3/h9H,4-8H2,1-3H3,(H,12,13,14)/t9-/m1/s1
InChIKeyADIJUMRWJXSWLV-SECBINFHSA-N
XLogP0.74
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine with MolForge

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Related Compounds

6-ethyl-2-N,2-N-dimethyl-4-N-[(2R)-1-morpholin-4-ylpropan-2-yl]pyrimidine-2,4-diamine
CID 95132117
3-ethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,2,4-thiadiazol-5-amine
CID 65276551
3-N,3-N-dimethyl-5-N-propan-2-yl-1,2,4-thiadiazole-3,5-diamine
CID 65269163
N-(1-morpholin-4-ylpropan-2-yl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285037
4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 62861950
3-N,3-N-dimethyl-5-N-[1-(1-methylpiperidin-4-yl)ethyl]-1,2,4-thiadiazole-3,5-diamine
CID 122560491
5,6-diethyl-N-(1-morpholin-4-ylpropan-2-yl)-1,2,4-triazin-3-amine
CID 105362530
[4-[[[3-(dimethylamino)-1,2,4-thiadiazol-5-yl]amino]methyl]oxan-4-yl]methanol
CID 122565094
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyrazin-2-amine
CID 47370622
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 63586349
2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
CID 79633115
2-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-4-amine
CID 103721807

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine?
The IUPAC name of 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine (CID 125446673) is 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine is C[C@H](CN1CCOCC1)Nc1nc(N(C)C)ns1.
What is the InChIKey of 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine?
The InChIKey is ADIJUMRWJXSWLV-SECBINFHSA-N. The full InChI is InChI=1S/C11H21N5OS/c1-9(8-16-4-6-17-7-5-16)12-11-13-10(14-18-11)15(2)3/h9H,4-8H2,1-3H3,(H,12,13,14)/t9-/m1/s1.
What are the key properties of 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine?
3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine has a molecular weight of 271.39 g/mol, XLogP of 0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-5-N-[(2R)-1-morpholin-4-ylpropan-2-yl]-1,2,4-thiadiazole-3,5-diamine is sourced from PubChem (CID 125446673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).