4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine

C9H15N3S2 — CID 65484449

IUPAC4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine
SMILESNc1nc(CCN2CCSCC2)cs1
InChIInChI=1S/C9H15N3S2/c10-9-11-8(7-14-9)1-2-12-3-5-13-6-4-12/h7H,1-6H2,(H2,10,11)
InChIKeyOEUVRDGEFDKOPD-UHFFFAOYSA-N
MW229.37 g/mol
LogP1.32
Rot. Bonds3

About 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine

4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine (PubChem CID 65484449) has the molecular formula C9H15N3S2 and a molecular weight of 229.37 g/mol. Its IUPAC name is 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine
PubChem CID65484449
Molecular FormulaC9H15N3S2
Molecular Weight229.37 g/mol
Exact Mass229.07
IUPAC Name4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine
SMILESNc1nc(CCN2CCSCC2)cs1
InChIInChI=1S/C9H15N3S2/c10-9-11-8(7-14-9)1-2-12-3-5-13-6-4-12/h7H,1-6H2,(H2,10,11)
InChIKeyOEUVRDGEFDKOPD-UHFFFAOYSA-N
XLogP1.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-piperazin-1-ylethyl)-1,3-thiazol-2-amine
CID 82508561
4-[2-(4-propylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65484061
4-[2-(2,5-dihydropyrrol-1-yl)ethyl]-1,3-thiazol-2-amine
CID 130735866
4-[2-(4-butan-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65484466
2-(2-amino-1,3-thiazol-4-yl)-N-(2-thiomorpholin-4-ylethyl)acetamide
CID 106325273
4-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-1,3-thiazol-2-amine
CID 65484861
4-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)ethyl]-1,3-thiazol-2-amine
CID 65482915
4-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-1,3-thiazol-2-amine
CID 65483300
4-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65483873
4-[3-[4-(chloromethyl)-1,3-thiazol-2-yl]propyl]thiomorpholine
CID 43138391
4-(2-fluoroethyl)-1,3-thiazol-2-amine
CID 83854193
6-[2-(1,4-thiazepan-4-yl)ethyl]pyridin-3-amine
CID 107340112

Frequently Asked Questions

What is the IUPAC name of 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine (CID 65484449) is 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine is Nc1nc(CCN2CCSCC2)cs1.
What is the InChIKey of 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine?
The InChIKey is OEUVRDGEFDKOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S2/c10-9-11-8(7-14-9)1-2-12-3-5-13-6-4-12/h7H,1-6H2,(H2,10,11).
What are the key properties of 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine?
4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine has a molecular weight of 229.37 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-thiomorpholin-4-ylethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 65484449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).