4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine

C15H18N2O3S — CID 653894

IUPAC4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine
SMILESCOc1ccc(-c2csc(N3CCOCC3)n2)cc1OC
InChIInChI=1S/C15H18N2O3S/c1-18-13-4-3-11(9-14(13)19-2)12-10-21-15(16-12)17-5-7-20-8-6-17/h3-4,9-10H,5-8H2,1-2H3
InChIKeyWZTHHDXVZGTKEG-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.66
Rot. Bonds4

About 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine

4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine (PubChem CID 653894) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine
PubChem CID653894
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC Name4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine
SMILESCOc1ccc(-c2csc(N3CCOCC3)n2)cc1OC
InChIInChI=1S/C15H18N2O3S/c1-18-13-4-3-11(9-14(13)19-2)12-10-21-15(16-12)17-5-7-20-8-6-17/h3-4,9-10H,5-8H2,1-2H3
InChIKeyWZTHHDXVZGTKEG-UHFFFAOYSA-N
XLogP2.66
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3,4-dimethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 556017
4-(3,4-Dimethoxyphenyl)-1,3-thiazol-2-amine
CID 332397
N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyridin-2-amine
CID 1092442
4-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]thiomorpholine
CID 1490762
N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-methylsulfanylacetamide
CID 2444242
N-cyclohexyl-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 4791502
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-prop-2-enyl-1,3-thiazol-2-amine
CID 8961860
3-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]propanamide
CID 24818334
4-(4-Methoxyphenyl)-2-(3-phenylpyrrolidin-1-yl)-1,3-thiazole
CID 3889772
N-Ethyl-N-[4-(4-methoxy-phenyl)-thiazol-2-yl]-propionamide
CID 645119
4-(3,4-dimethoxyphenyl)-N-(3-methyl-2-pyridinyl)-2-thiazolamine
CID 973120
[4-(3,4-Dimethoxy-phenyl)-thiazol-2-yl]-(4-methyl-pyridin-2-yl)-amine
CID 2877445

Frequently Asked Questions

What is the IUPAC name of 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine?
The IUPAC name of 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine (CID 653894) is 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine.
What is the SMILES notation for 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine?
The canonical SMILES for 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine is COc1ccc(-c2csc(N3CCOCC3)n2)cc1OC.
What is the InChIKey of 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine?
The InChIKey is WZTHHDXVZGTKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-18-13-4-3-11(9-14(13)19-2)12-10-21-15(16-12)17-5-7-20-8-6-17/h3-4,9-10H,5-8H2,1-2H3.
What are the key properties of 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine?
4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine has a molecular weight of 306.39 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]morpholine is sourced from PubChem (CID 653894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).