6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine

C15H18N2O2S — CID 82059368

IUPAC6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine
SMILESCOCCc1nc(-c2ccc3c(c2)NCCO3)c(C)s1
InChIInChI=1S/C15H18N2O2S/c1-10-15(17-14(20-10)5-7-18-2)11-3-4-13-12(9-11)16-6-8-19-13/h3-4,9,16H,5-8H2,1-2H3
InChIKeyDGNZMSRWXZLLMD-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.11
Rot. Bonds4

About 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine

6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine (PubChem CID 82059368) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine.

Molecular Properties

Compound Name6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine
PubChem CID82059368
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine
SMILESCOCCc1nc(-c2ccc3c(c2)NCCO3)c(C)s1
InChIInChI=1S/C15H18N2O2S/c1-10-15(17-14(20-10)5-7-18-2)11-3-4-13-12(9-11)16-6-8-19-13/h3-4,9,16H,5-8H2,1-2H3
InChIKeyDGNZMSRWXZLLMD-UHFFFAOYSA-N
XLogP3.11
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine with MolForge

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Related Compounds

O-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-thiazol-2-yl]methyl]hydroxylamine
CID 39377180
O-[2-[5-methyl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]ethyl]hydroxylamine
CID 39390793
O-[2-[4-(3,4-dimethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]ethyl]hydroxylamine
CID 39403548
6-[2-methyl-4-(3,4,5-trimethoxyphenyl)-1H-imidazol-5-yl]-3,4-dihydro-2H-1,4-benzoxazine
CID 151495759
6-(3-methylphenyl)-3,4-dihydro-2H-1,4-benzoxazine
CID 116817431
6-[5-[(2-methyl-4H-azepin-7-yl)methyl]-2H-triazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine
CID 142830801
4-(4-tert-butylphenyl)-2-(3-methoxypropyl)-5-methyl-1,3-thiazole
CID 60587964
[4-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-(2-methyl-4-pyridinyl)-1H-imidazol-2-yl]methanamine
CID 142578057
1-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-N-(2-methoxyethyl)butan-2-amine
CID 82261347
4-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-pyridin-4-yl-1H-imidazol-2-amine
CID 142578133
4-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-N-methyl-5-(2-methyl-4-pyridinyl)-1H-imidazol-2-amine
CID 142578036
2-[bis(2-methoxyethyl)amino]-1-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)ethanone
CID 95415184

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine?
The IUPAC name of 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine (CID 82059368) is 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine.
What is the SMILES notation for 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine?
The canonical SMILES for 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine is COCCc1nc(-c2ccc3c(c2)NCCO3)c(C)s1.
What is the InChIKey of 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine?
The InChIKey is DGNZMSRWXZLLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-10-15(17-14(20-10)5-7-18-2)11-3-4-13-12(9-11)16-6-8-19-13/h3-4,9,16H,5-8H2,1-2H3.
What are the key properties of 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine?
6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine has a molecular weight of 290.39 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-methoxyethyl)-5-methyl-1,3-thiazol-4-yl]-3,4-dihydro-2H-1,4-benzoxazine is sourced from PubChem (CID 82059368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).