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

C8H11N3O2S — CID 22397226

IUPAC(5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone
SMILESNc1cnc(C(=O)N2CCOCC2)s1
InChIInChI=1S/C8H11N3O2S/c9-6-5-10-7(14-6)8(12)11-1-3-13-4-2-11/h5H,1-4,9H2
InChIKeyJNBIWLVAAIXHFP-UHFFFAOYSA-N
MW213.26 g/mol
LogP0.20
Rot. Bonds1

About (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone

(5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone (PubChem CID 22397226) has the molecular formula C8H11N3O2S and a molecular weight of 213.26 g/mol. Its IUPAC name is (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone
PubChem CID22397226
Molecular FormulaC8H11N3O2S
Molecular Weight213.26 g/mol
Exact Mass213.06
IUPAC Name(5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone
SMILESNc1cnc(C(=O)N2CCOCC2)s1
InChIInChI=1S/C8H11N3O2S/c9-6-5-10-7(14-6)8(12)11-1-3-13-4-2-11/h5H,1-4,9H2
InChIKeyJNBIWLVAAIXHFP-UHFFFAOYSA-N
XLogP0.20
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.26
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Ethyl 5-amino-1,3-thiazole-2-carboxylate
CID 21955445
(2-Methoxyethyl)[2-(4-methylpiperazin-1-yl)-2-oxoethyl](1,3-thiazol-2-ylmethyl)amine
CID 91831618
2-(Morpholin-4-ylmethyl)-1,3-thiazol-5-amine
CID 22397141
Butyl 5-amino-1,3-thiazole-2-carboxylate
CID 73011162
5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide
CID 83695506
Morpholin-4-yl(1,3-thiazol-2-yl)methanone
CID 91804730
[2-(Morpholin-4-ylmethyl)-1,3-thiazol-5-yl]carbamic acid
CID 140169249
Morpholin-4-yl-(5-nitro-1,3-thiazol-2-yl)methanone
CID 154244800
N-methyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine
CID 158263053
2-Chloro-1-morpholin-4-ylethanone;1,3-thiazol-5-amine
CID 162023288
5-Morpholin-4-yl-1,3-thiazole-2-carbaldehyde
CID 164924917
N-methyl-5-piperazin-1-yl-1,3-thiazole-2-carboxamide;hydrochloride
CID 175560044

Frequently Asked Questions

What is the IUPAC name of (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone (CID 22397226) is (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone is Nc1cnc(C(=O)N2CCOCC2)s1.
What is the InChIKey of (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone?
The InChIKey is JNBIWLVAAIXHFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2S/c9-6-5-10-7(14-6)8(12)11-1-3-13-4-2-11/h5H,1-4,9H2.
What are the key properties of (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone?
(5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone has a molecular weight of 213.26 g/mol, XLogP of 0.20, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-1,3-thiazol-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 22397226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).