2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine

C13H23N3OS — CID 82427748

IUPAC2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine
SMILESCc1nc(CCN2CCOCC2)sc1C(C)(C)N
InChIInChI=1S/C13H23N3OS/c1-10-12(13(2,3)14)18-11(15-10)4-5-16-6-8-17-9-7-16/h4-9,14H2,1-3H3
InChIKeyOICSMJDMIISREW-UHFFFAOYSA-N
MW269.41 g/mol
LogP1.52
Rot. Bonds4

About 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine

2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine (PubChem CID 82427748) has the molecular formula C13H23N3OS and a molecular weight of 269.41 g/mol. Its IUPAC name is 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine.

Molecular Properties

Compound Name2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine
PubChem CID82427748
Molecular FormulaC13H23N3OS
Molecular Weight269.41 g/mol
Exact Mass269.16
IUPAC Name2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine
SMILESCc1nc(CCN2CCOCC2)sc1C(C)(C)N
InChIInChI=1S/C13H23N3OS/c1-10-12(13(2,3)14)18-11(15-10)4-5-16-6-8-17-9-7-16/h4-9,14H2,1-3H3
InChIKeyOICSMJDMIISREW-UHFFFAOYSA-N
XLogP1.52
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)propan-2-amine
CID 82427984
4-[2-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]morpholine
CID 58668541
[2-(2-morpholin-4-ylethyl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 82433206
2-[4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-5-yl]propan-2-amine
CID 82427520
2-[4-ethyl-2-[2-(4-methylpiperidin-1-yl)ethyl]-1,3-thiazol-5-yl]propan-2-amine
CID 82430776
1-[4-ethyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
CID 82430826
2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol
CID 82515189
4-cyclopropyl-2-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carbohydrazide
CID 82437904
1-[4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
CID 82441721
4-(methoxymethyl)-2-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carbothioamide
CID 82441712
5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
CID 94696966
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 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine?
The IUPAC name of 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine (CID 82427748) is 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine.
What is the SMILES notation for 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine?
The canonical SMILES for 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine is Cc1nc(CCN2CCOCC2)sc1C(C)(C)N.
What is the InChIKey of 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine?
The InChIKey is OICSMJDMIISREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3OS/c1-10-12(13(2,3)14)18-11(15-10)4-5-16-6-8-17-9-7-16/h4-9,14H2,1-3H3.
What are the key properties of 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine?
2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine has a molecular weight of 269.41 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine is sourced from PubChem (CID 82427748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).