furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone

C13H14N2O3S — CID 97484452

IUPACfuran-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
SMILESCc1nc([C@H]2COCCN2C(=O)c2ccoc2)cs1
InChIInChI=1S/C13H14N2O3S/c1-9-14-11(8-19-9)12-7-18-5-3-15(12)13(16)10-2-4-17-6-10/h2,4,6,8,12H,3,5,7H2,1H3/t12-/m1/s1
InChIKeyJIOOXOOBIYOBMY-GFCCVEGCSA-N
MW278.33 g/mol
LogP2.26
Rot. Bonds2

About furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone

furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone (PubChem CID 97484452) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
PubChem CID97484452
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Namefuran-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
SMILESCc1nc([C@H]2COCCN2C(=O)c2ccoc2)cs1
InChIInChI=1S/C13H14N2O3S/c1-9-14-11(8-19-9)12-7-18-5-3-15(12)13(16)10-2-4-17-6-10/h2,4,6,8,12H,3,5,7H2,1H3/t12-/m1/s1
InChIKeyJIOOXOOBIYOBMY-GFCCVEGCSA-N
XLogP2.26
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(1-methylpyrazol-4-yl)-[(3R)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
CID 97485259
[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 97486089
(3-methyl-1-benzofuran-2-yl)-[(3R)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
CID 97485782
[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-quinolin-4-ylmethanone
CID 131659440
cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
CID 97485709
(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
CID 131653318
1-[(3R)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-2-thiophen-3-ylethanone
CID 97485469
2-(4-methylphenoxy)-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone
CID 131654980
1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-2-pyridin-2-ylethanone
CID 131657943
[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-quinolin-2-ylmethanone;2,2,2-trifluoroacetic acid
CID 155842614
3-(4-chlorophenyl)-1-[(3R)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]propan-1-one
CID 97485746
4-(furan-2-ylmethyl)-3-(2-methyl-1,3-thiazol-4-yl)morpholine
CID 131646432

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The IUPAC name of furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone (CID 97484452) is furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone.
What is the SMILES notation for furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The canonical SMILES for furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone is Cc1nc([C@H]2COCCN2C(=O)c2ccoc2)cs1.
What is the InChIKey of furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The InChIKey is JIOOXOOBIYOBMY-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-9-14-11(8-19-9)12-7-18-5-3-15(12)13(16)10-2-4-17-6-10/h2,4,6,8,12H,3,5,7H2,1H3/t12-/m1/s1.
What are the key properties of furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone has a molecular weight of 278.33 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 97484452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).