3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine

C11H13N3O2S — CID 167814797

IUPAC3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
SMILESCOCc1csc(-c2cnc3n2CCOC3)n1
InChIInChI=1S/C11H13N3O2S/c1-15-5-8-7-17-11(13-8)9-4-12-10-6-16-3-2-14(9)10/h4,7H,2-3,5-6H2,1H3
InChIKeyBPXHHCYNQOAUDU-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.68
Rot. Bonds3

About 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine

3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine (PubChem CID 167814797) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine.

Molecular Properties

Compound Name3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
PubChem CID167814797
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC Name3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
SMILESCOCc1csc(-c2cnc3n2CCOC3)n1
InChIInChI=1S/C11H13N3O2S/c1-15-5-8-7-17-11(13-8)9-4-12-10-6-16-3-2-14(9)10/h4,7H,2-3,5-6H2,1H3
InChIKeyBPXHHCYNQOAUDU-UHFFFAOYSA-N
XLogP1.68
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3,5-dichloro-2-pyridinyl)-4-(methoxymethyl)-1,3-thiazole
CID 107512046
2-[4-(methoxymethyl)-1,3-thiazol-2-yl]aniline
CID 107507057
2-(4-bromothiophen-3-yl)-4-(methoxymethyl)-1,3-thiazole
CID 167839205
2-(3-chloro-2-pyridinyl)-4-(methoxymethyl)-1,3-thiazole
CID 107511905
2-(3-fluoro-2-pyridinyl)-4-(methoxymethyl)-1,3-thiazole
CID 107512025
4-(methoxymethyl)-2-(4-methylsulfanylphenyl)-1,3-thiazole
CID 107511959
2-(3-bromophenyl)-4-(methoxymethyl)-1,3-thiazole
CID 107511692
3-(methanesulfonamidomethyl)-N-[4-(methoxymethyl)-1,3-thiazol-2-yl]morpholine-4-carboxamide
CID 131963807
2-[4-(methoxymethyl)-1,3-thiazol-2-yl]-1,1-dimethylhydrazine
CID 131059203
2-(2-chloro-4-fluorophenyl)-4-(methoxymethyl)-1,3-thiazole
CID 107511921
4-(methoxymethyl)-2-(4-nitrophenyl)-1,3-thiazole
CID 107511770
3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
CID 164651800

Frequently Asked Questions

What is the IUPAC name of 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The IUPAC name of 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine (CID 167814797) is 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine.
What is the SMILES notation for 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The canonical SMILES for 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine is COCc1csc(-c2cnc3n2CCOC3)n1.
What is the InChIKey of 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The InChIKey is BPXHHCYNQOAUDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c1-15-5-8-7-17-11(13-8)9-4-12-10-6-16-3-2-14(9)10/h4,7H,2-3,5-6H2,1H3.
What are the key properties of 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine has a molecular weight of 251.31 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(methoxymethyl)-1,3-thiazol-2-yl]-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine is sourced from PubChem (CID 167814797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).