2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine

C11H20N4OS — CID 43663966

IUPAC2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine
SMILESCC(C)(CNCc1csnn1)N1CCOCC1
InChIInChI=1S/C11H20N4OS/c1-11(2,15-3-5-16-6-4-15)9-12-7-10-8-17-14-13-10/h8,12H,3-7,9H2,1-2H3
InChIKeyPPQNOWVZAWVQFY-UHFFFAOYSA-N
MW256.37 g/mol
LogP0.74
Rot. Bonds5

About 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine

2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine (PubChem CID 43663966) has the molecular formula C11H20N4OS and a molecular weight of 256.37 g/mol. Its IUPAC name is 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine
PubChem CID43663966
Molecular FormulaC11H20N4OS
Molecular Weight256.37 g/mol
Exact Mass256.14
IUPAC Name2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine
SMILESCC(C)(CNCc1csnn1)N1CCOCC1
InChIInChI=1S/C11H20N4OS/c1-11(2,15-3-5-16-6-4-15)9-12-7-10-8-17-14-13-10/h8,12H,3-7,9H2,1-2H3
InChIKeyPPQNOWVZAWVQFY-UHFFFAOYSA-N
XLogP0.74
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine?
The IUPAC name of 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine (CID 43663966) is 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine?
The canonical SMILES for 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine is CC(C)(CNCc1csnn1)N1CCOCC1.
What is the InChIKey of 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine?
The InChIKey is PPQNOWVZAWVQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4OS/c1-11(2,15-3-5-16-6-4-15)9-12-7-10-8-17-14-13-10/h8,12H,3-7,9H2,1-2H3.
What are the key properties of 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine?
2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine has a molecular weight of 256.37 g/mol, XLogP of 0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-morpholin-4-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine is sourced from PubChem (CID 43663966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).