[2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine

C12H21N3OS — CID 62766514

IUPAC[2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine
SMILESCCc1nc(N2CC(C)OC(C)C2)sc1CN
InChIInChI=1S/C12H21N3OS/c1-4-10-11(5-13)17-12(14-10)15-6-8(2)16-9(3)7-15/h8-9H,4-7,13H2,1-3H3
InChIKeyWRXFKFBEFHRZMT-UHFFFAOYSA-N
MW255.39 g/mol
LogP1.78
Rot. Bonds3

About [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine

[2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine (PubChem CID 62766514) has the molecular formula C12H21N3OS and a molecular weight of 255.39 g/mol. Its IUPAC name is [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine
PubChem CID62766514
Molecular FormulaC12H21N3OS
Molecular Weight255.39 g/mol
Exact Mass255.14
IUPAC Name[2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine
SMILESCCc1nc(N2CC(C)OC(C)C2)sc1CN
InChIInChI=1S/C12H21N3OS/c1-4-10-11(5-13)17-12(14-10)15-6-8(2)16-9(3)7-15/h8-9H,4-7,13H2,1-3H3
InChIKeyWRXFKFBEFHRZMT-UHFFFAOYSA-N
XLogP1.78
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.39
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-propyl-1,3-thiazol-5-yl]methanamine
CID 104961227
[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine
CID 115562457
[2-(3,4-dimethylpyrrolidin-1-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanamine
CID 107510564
[4-ethyl-2-(2-methylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 62765484
[4-ethyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanol
CID 62780833
[2-(3,5-dimethylpiperidin-1-yl)-4-ethyl-1,3-thiazol-5-yl]methanol
CID 62780489
[4-ethyl-2-(2-ethyl-5-methylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 83221011
[4-ethyl-2-[4-(2-methylpropyl)piperazin-1-yl]-1,3-thiazol-5-yl]methanamine
CID 62777571
[4-ethyl-2-(3-propoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 62769335
[2-(2,6-dimethylmorpholin-4-yl)-5-(2,5-dimethyl-4-pyridinyl)-1,3-thiazol-4-yl]methanamine
CID 77447384
[2-(2-ethylmorpholin-4-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 55117413
N-[[2-(2,6-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 62763985

Frequently Asked Questions

What is the IUPAC name of [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine (CID 62766514) is [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine is CCc1nc(N2CC(C)OC(C)C2)sc1CN.
What is the InChIKey of [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
The InChIKey is WRXFKFBEFHRZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3OS/c1-4-10-11(5-13)17-12(14-10)15-6-8(2)16-9(3)7-15/h8-9H,4-7,13H2,1-3H3.
What are the key properties of [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
[2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine has a molecular weight of 255.39 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dimethylmorpholin-4-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 62766514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).