(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine

C8H12N2OS — CID 96626970

IUPAC(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine
SMILESCc1nc([C@H]2COCCN2)cs1
InChIInChI=1S/C8H12N2OS/c1-6-10-8(5-12-6)7-4-11-3-2-9-7/h5,7,9H,2-4H2,1H3/t7-/m1/s1
InChIKeyOVWMNENIQJRNRP-SSDOTTSWSA-N
MW184.26 g/mol
LogP1.11
Rot. Bonds1

About (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine

(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine (PubChem CID 96626970) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine.

Molecular Properties

Compound Name(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine
PubChem CID96626970
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine
SMILESCc1nc([C@H]2COCCN2)cs1
InChIInChI=1S/C8H12N2OS/c1-6-10-8(5-12-6)7-4-11-3-2-9-7/h5,7,9H,2-4H2,1H3/t7-/m1/s1
InChIKeyOVWMNENIQJRNRP-SSDOTTSWSA-N
XLogP1.11
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-morpholin-3-yl-1,3-thiazol-2-yl)formamide
CID 135308391
3-(2-methyl-1,3-thiazol-4-yl)thiomorpholine
CID 82397404
3-[2-(2-ethoxybutan-2-yl)-1,3-thiazol-4-yl]morpholine
CID 102929501
3-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]morpholine
CID 102748188
3-[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]morpholine
CID 102748197
3-(4-cyclopentyl-1,3-thiazol-2-yl)morpholine;hydrochloride
CID 120581945
3-[4-(oxolan-3-yl)-1,3-thiazol-2-yl]morpholine;hydrochloride
CID 120581948
3-(4-phenyl-1,3-thiazol-2-yl)morpholine
CID 83439832
3-[4-(1-methylpyrrolidin-3-yl)-1,3-thiazol-2-yl]morpholine
CID 116966504
3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)-1,4-oxazepane
CID 82621367
3-(1,2-oxazol-3-yl)morpholine
CID 82595372
3-pyridin-2-ylmorpholine
CID 54247101

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine?
The IUPAC name of (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine (CID 96626970) is (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine.
What is the SMILES notation for (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine?
The canonical SMILES for (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine is Cc1nc([C@H]2COCCN2)cs1.
What is the InChIKey of (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine?
The InChIKey is OVWMNENIQJRNRP-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-6-10-8(5-12-6)7-4-11-3-2-9-7/h5,7,9H,2-4H2,1H3/t7-/m1/s1.
What are the key properties of (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine?
(3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine has a molecular weight of 184.26 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(2-methyl-1,3-thiazol-4-yl)morpholine is sourced from PubChem (CID 96626970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).