1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol

C10H18N4O2S — CID 133383205

IUPAC1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESCc1nnc(NCC(O)CN2CCOCC2)s1
InChIInChI=1S/C10H18N4O2S/c1-8-12-13-10(17-8)11-6-9(15)7-14-2-4-16-5-3-14/h9,15H,2-7H2,1H3,(H,11,13)
InChIKeyAKZVIZNUCZGPNT-UHFFFAOYSA-N
MW258.35 g/mol
LogP-0.05
Rot. Bonds5

About 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol

1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 133383205) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
PubChem CID133383205
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESCc1nnc(NCC(O)CN2CCOCC2)s1
InChIInChI=1S/C10H18N4O2S/c1-8-12-13-10(17-8)11-6-9(15)7-14-2-4-16-5-3-14/h9,15H,2-7H2,1H3,(H,11,13)
InChIKeyAKZVIZNUCZGPNT-UHFFFAOYSA-N
XLogP-0.05
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol (CID 133383205) is 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol is Cc1nnc(NCC(O)CN2CCOCC2)s1.
What is the InChIKey of 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is AKZVIZNUCZGPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-8-12-13-10(17-8)11-6-9(15)7-14-2-4-16-5-3-14/h9,15H,2-7H2,1H3,(H,11,13).
What are the key properties of 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 258.35 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 133383205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).