N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine

C11H21N3OS — CID 83019190

IUPACN-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine
SMILESCCC1(CC)CSC(NN2CCOCC2)=N1
InChIInChI=1S/C11H21N3OS/c1-3-11(4-2)9-16-10(12-11)13-14-5-7-15-8-6-14/h3-9H2,1-2H3,(H,12,13)
InChIKeyYOWBVZADXPBAQI-UHFFFAOYSA-N
MW243.38 g/mol
LogP1.48
Rot. Bonds3

About N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine

N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine (PubChem CID 83019190) has the molecular formula C11H21N3OS and a molecular weight of 243.38 g/mol. Its IUPAC name is N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine.

Molecular Properties

Compound NameN-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine
PubChem CID83019190
Molecular FormulaC11H21N3OS
Molecular Weight243.38 g/mol
Exact Mass243.14
IUPAC NameN-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine
SMILESCCC1(CC)CSC(NN2CCOCC2)=N1
InChIInChI=1S/C11H21N3OS/c1-3-11(4-2)9-16-10(12-11)13-14-5-7-15-8-6-14/h3-9H2,1-2H3,(H,12,13)
InChIKeyYOWBVZADXPBAQI-UHFFFAOYSA-N
XLogP1.48
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine?
The IUPAC name of N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine (CID 83019190) is N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine.
What is the SMILES notation for N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine?
The canonical SMILES for N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine is CCC1(CC)CSC(NN2CCOCC2)=N1.
What is the InChIKey of N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine?
The InChIKey is YOWBVZADXPBAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3OS/c1-3-11(4-2)9-16-10(12-11)13-14-5-7-15-8-6-14/h3-9H2,1-2H3,(H,12,13).
What are the key properties of N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine?
N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine has a molecular weight of 243.38 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-diethyl-5H-1,3-thiazol-2-yl)morpholin-4-amine is sourced from PubChem (CID 83019190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).