2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone

C9H13N3O2S — CID 62797092

IUPAC2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone
SMILESNc1nc(CC(=O)N2CCOCC2)cs1
InChIInChI=1S/C9H13N3O2S/c10-9-11-7(6-15-9)5-8(13)12-1-3-14-4-2-12/h6H,1-5H2,(H2,10,11)
InChIKeyKOGDPALVKXXOHD-UHFFFAOYSA-N
MW227.29 g/mol
LogP0.13
Rot. Bonds2

About 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone

2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone (PubChem CID 62797092) has the molecular formula C9H13N3O2S and a molecular weight of 227.29 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone
PubChem CID62797092
Molecular FormulaC9H13N3O2S
Molecular Weight227.29 g/mol
Exact Mass227.07
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone
SMILESNc1nc(CC(=O)N2CCOCC2)cs1
InChIInChI=1S/C9H13N3O2S/c10-9-11-7(6-15-9)5-8(13)12-1-3-14-4-2-12/h6H,1-5H2,(H2,10,11)
InChIKeyKOGDPALVKXXOHD-UHFFFAOYSA-N
XLogP0.13
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.29
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 87545771
CID 87545771
CID 3818242
CID 3818242
CID 42281841
CID 42281841
CID 42437024
CID 42437024
CID 44016051
CID 44016051
CID 72914518
CID 72914518
CID 45819394
CID 45819394
CID 70724854
CID 70724854
CID 118774916
CID 118774916
CID 47005401
CID 47005401
CID 55119883
CID 55119883
CID 62797699
CID 62797699

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone (CID 62797092) is 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone is Nc1nc(CC(=O)N2CCOCC2)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone?
The InChIKey is KOGDPALVKXXOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2S/c10-9-11-7(6-15-9)5-8(13)12-1-3-14-4-2-12/h6H,1-5H2,(H2,10,11).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone?
2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone has a molecular weight of 227.29 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 62797092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).