3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine

C9H16N4OS — CID 65269219

IUPAC3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine
SMILESCC(C)Nc1nc(N2CCOCC2)ns1
InChIInChI=1S/C9H16N4OS/c1-7(2)10-9-11-8(12-15-9)13-3-5-14-6-4-13/h7H,3-6H2,1-2H3,(H,10,11,12)
InChIKeyMUSSLGYUHNUVRJ-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.20
Rot. Bonds3

About 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine

3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine (PubChem CID 65269219) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine
PubChem CID65269219
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine
SMILESCC(C)Nc1nc(N2CCOCC2)ns1
InChIInChI=1S/C9H16N4OS/c1-7(2)10-9-11-8(12-15-9)13-3-5-14-6-4-13/h7H,3-6H2,1-2H3,(H,10,11,12)
InChIKeyMUSSLGYUHNUVRJ-UHFFFAOYSA-N
XLogP1.20
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(Morpholin-4-yl)-1,2,4-thiadiazol-5-amine
CID 21688987
3-methyl-N-(4-morpholin-4-ylbutyl)-1,2,4-thiadiazol-5-amine
CID 132380131
N,N-dibutyl-5-morpholin-4-yl-1,2,4-thiadiazol-3-amine
CID 321850
N-methyl-3-morpholin-4-yl-1,2,4-thiadiazol-5-amine
CID 65268966
N-tert-butyl-3-morpholin-4-yl-1,2,4-thiadiazol-5-amine
CID 65269181
N-(3-morpholin-4-yl-1,2,4-thiadiazol-5-yl)propanamide
CID 140163506
N-butan-2-yl-3-morpholin-4-yl-1,2,4-thiadiazol-5-amine
CID 169660613
ethane;N-methyl-3-morpholin-4-yl-1,2,4-thiadiazol-5-amine
CID 172264051
N-(azetidin-3-ylmethyl)-5-morpholin-4-yl-1,2,4-thiadiazol-3-amine
CID 176009599
3-Morpholin-4-yl-1,2,4-thiadiazol-5-amine;hydrochloride
CID 176276677
3-methyl-N-(1-morpholin-4-ylpropan-2-yl)-1,2,4-thiadiazol-5-amine
CID 65267457
3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine
CID 65267561

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine (CID 65269219) is 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine is CC(C)Nc1nc(N2CCOCC2)ns1.
What is the InChIKey of 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine?
The InChIKey is MUSSLGYUHNUVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-7(2)10-9-11-8(12-15-9)13-3-5-14-6-4-13/h7H,3-6H2,1-2H3,(H,10,11,12).
What are the key properties of 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine?
3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine has a molecular weight of 228.32 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-N-propan-2-yl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65269219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).