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

C14H18N2O2S — CID 97485709

IUPACcyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
SMILESCc1nc([C@H]2COCCN2C(=O)C2=CCCC2)cs1
InChIInChI=1S/C14H18N2O2S/c1-10-15-12(9-19-10)13-8-18-7-6-16(13)14(17)11-4-2-3-5-11/h4,9,13H,2-3,5-8H2,1H3/t13-/m1/s1
InChIKeySFUCBLUSNZXQKQ-CYBMUJFWSA-N
MW278.38 g/mol
LogP2.46
Rot. Bonds2

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

cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone (PubChem CID 97485709) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Namecyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
PubChem CID97485709
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC Namecyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
SMILESCc1nc([C@H]2COCCN2C(=O)C2=CCCC2)cs1
InChIInChI=1S/C14H18N2O2S/c1-10-15-12(9-19-10)13-8-18-7-6-16(13)14(17)11-4-2-3-5-11/h4,9,13H,2-3,5-8H2,1H3/t13-/m1/s1
InChIKeySFUCBLUSNZXQKQ-CYBMUJFWSA-N
XLogP2.46
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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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
furan-3-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
CID 97484452
[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-quinolin-4-ylmethanone
CID 131659440
(3-methyl-1-benzofuran-2-yl)-[(3R)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
CID 97485782
[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 97486089
(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
[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-quinolin-2-ylmethanone;2,2,2-trifluoroacetic acid
CID 155842614
1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]-2-pyridin-2-ylethanone
CID 131657943
3-(4-chlorophenyl)-1-[(3R)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]propan-1-one
CID 97485746
3-(2-methyl-1,3-thiazol-4-yl)-4-pyrimidin-2-ylmorpholine;2,2,2-trifluoroacetic acid
CID 155846689

Frequently Asked Questions

What is the IUPAC name of cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The IUPAC name of cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone (CID 97485709) is cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone.
What is the SMILES notation for cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The canonical SMILES for cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone is Cc1nc([C@H]2COCCN2C(=O)C2=CCCC2)cs1.
What is the InChIKey of cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The InChIKey is SFUCBLUSNZXQKQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-10-15-12(9-19-10)13-8-18-7-6-16(13)14(17)11-4-2-3-5-11/h4,9,13H,2-3,5-8H2,1H3/t13-/m1/s1.
What are the key properties of cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone has a molecular weight of 278.38 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenten-1-yl-[(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 97485709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).