1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine

C13H23N3O2S — CID 82441721

IUPAC1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
SMILESCOCc1nc(CCN2CCOCC2)sc1C(C)N
InChIInChI=1S/C13H23N3O2S/c1-10(14)13-11(9-17-2)15-12(19-13)3-4-16-5-7-18-8-6-16/h10H,3-9,14H2,1-2H3
InChIKeyZTMWNPRJGDTNLI-UHFFFAOYSA-N
MW285.41 g/mol
LogP1.18
Rot. Bonds6

About 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine

1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine (PubChem CID 82441721) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
PubChem CID82441721
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC Name1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
SMILESCOCc1nc(CCN2CCOCC2)sc1C(C)N
InChIInChI=1S/C13H23N3O2S/c1-10(14)13-11(9-17-2)15-12(19-13)3-4-16-5-7-18-8-6-16/h10H,3-9,14H2,1-2H3
InChIKeyZTMWNPRJGDTNLI-UHFFFAOYSA-N
XLogP1.18
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[4-ethyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
CID 82430826
4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carbothioamide
CID 82441712
1-[2,4-bis(methoxymethyl)-1,3-thiazol-5-yl]ethanamine
CID 82441413
1-[2-[2-(azepan-1-yl)ethyl]-4-ethyl-1,3-thiazol-5-yl]ethanamine
CID 82430846
1-[4-propan-2-yl-2-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-5-yl]ethanamine
CID 82435434
1-[2-[(dimethylamino)methyl]-4-(methoxymethyl)-1,3-thiazol-5-yl]ethanamine
CID 82441447
[2-(2-morpholin-4-ylethyl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 82433206
[4-(methoxymethyl)-2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-5-yl]methanamine
CID 82441701
2-[2-(azepan-1-yl)ethyl]-4-(methoxymethyl)-1,3-thiazole-5-carboxylic acid
CID 82227659
1-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-amine
CID 115089637
[4-(methoxymethyl)-2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-5-yl]methanol
CID 82441695
2-[2-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-5-yl]acetic acid
CID 82435498

Frequently Asked Questions

What is the IUPAC name of 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine?
The IUPAC name of 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine (CID 82441721) is 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine.
What is the SMILES notation for 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine?
The canonical SMILES for 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine is COCc1nc(CCN2CCOCC2)sc1C(C)N.
What is the InChIKey of 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine?
The InChIKey is ZTMWNPRJGDTNLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-10(14)13-11(9-17-2)15-12(19-13)3-4-16-5-7-18-8-6-16/h10H,3-9,14H2,1-2H3.
What are the key properties of 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine?
1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine has a molecular weight of 285.41 g/mol, XLogP of 1.18, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine is sourced from PubChem (CID 82441721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).