4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine

C8H13N3OS — CID 151923915

IUPAC4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine
SMILESCc1nc(N2CCOCC2N)cs1
InChIInChI=1S/C8H13N3OS/c1-6-10-8(5-13-6)11-2-3-12-4-7(11)9/h5,7H,2-4,9H2,1H3
InChIKeySXITWUQCRMDIOJ-UHFFFAOYSA-N
MW199.28 g/mol
LogP0.57
Rot. Bonds1

About 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine

4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine (PubChem CID 151923915) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine.

Molecular Properties

Compound Name4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine
PubChem CID151923915
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC Name4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine
SMILESCc1nc(N2CCOCC2N)cs1
InChIInChI=1S/C8H13N3OS/c1-6-10-8(5-13-6)11-2-3-12-4-7(11)9/h5,7H,2-4,9H2,1H3
InChIKeySXITWUQCRMDIOJ-UHFFFAOYSA-N
XLogP0.57
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine?
The IUPAC name of 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine (CID 151923915) is 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine.
What is the SMILES notation for 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine?
The canonical SMILES for 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine is Cc1nc(N2CCOCC2N)cs1.
What is the InChIKey of 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine?
The InChIKey is SXITWUQCRMDIOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c1-6-10-8(5-13-6)11-2-3-12-4-7(11)9/h5,7H,2-4,9H2,1H3.
What are the key properties of 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine?
4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine has a molecular weight of 199.28 g/mol, XLogP of 0.57, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-1,3-thiazol-4-yl)morpholin-3-amine is sourced from PubChem (CID 151923915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).