4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine

C12H18N2OS — CID 122153083

IUPAC4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine
SMILESCC1(C)CCc2sc(N3CCOCC3)nc21
InChIInChI=1S/C12H18N2OS/c1-12(2)4-3-9-10(12)13-11(16-9)14-5-7-15-8-6-14/h3-8H2,1-2H3
InChIKeyOHDAFLOIHPAQTJ-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.20
Rot. Bonds1

About 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine

4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine (PubChem CID 122153083) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine.

Molecular Properties

Compound Name4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine
PubChem CID122153083
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine
SMILESCC1(C)CCc2sc(N3CCOCC3)nc21
InChIInChI=1S/C12H18N2OS/c1-12(2)4-3-9-10(12)13-11(16-9)14-5-7-15-8-6-14/h3-8H2,1-2H3
InChIKeyOHDAFLOIHPAQTJ-UHFFFAOYSA-N
XLogP2.20
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[5-Tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
CID 58486394
5,5-Dimethyl-2-(morpholin-4-yl)-5,6-dihydro-1,3-benzothiazole-7(4h)-thione
CID 11999036
4-(4-Methyl-5-propan-2-yl-1,3-thiazol-2-yl)morpholine
CID 58154697
N,N,1'-trimethylspiro[4,6-dihydrocyclopenta[d][1,3]thiazole-5,4'-piperidine]-2-amine
CID 167047828
4-(5-Ethyl-4-propan-2-yl-1,3-thiazol-2-yl)morpholine
CID 169110237
4-(5-Tert-butyl-4-methyl-1,3-thiazol-2-yl)morpholine
CID 179038305
N-(2-methoxyethyl)-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
CID 65046962
4,4-Dimethyl-2-piperazin-1-yl-5,6-dihydrocyclopenta[d][1,3]thiazole
CID 79856758
N-(2-methoxyethyl)-4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-amine
CID 79864466
2-(4-Tert-butyl-2-morpholin-4-yl-1,3-thiazol-5-yl)acetonitrile
CID 82439732
N-(2-methoxyethyl)-4,6,6-trimethyl-4,5-dihydrocyclopenta[d][1,3]thiazol-2-amine
CID 106662910
N-propan-2-ylspiro[5,6-dihydrocyclopenta[d][1,3]thiazole-4,4'-oxane]-2-amine
CID 114244655

Frequently Asked Questions

What is the IUPAC name of 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine?
The IUPAC name of 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine (CID 122153083) is 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine.
What is the SMILES notation for 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine?
The canonical SMILES for 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine is CC1(C)CCc2sc(N3CCOCC3)nc21.
What is the InChIKey of 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine?
The InChIKey is OHDAFLOIHPAQTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-12(2)4-3-9-10(12)13-11(16-9)14-5-7-15-8-6-14/h3-8H2,1-2H3.
What are the key properties of 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine?
4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine has a molecular weight of 238.36 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-yl)morpholine is sourced from PubChem (CID 122153083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).