2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole

C15H14N2OS — CID 102846975

IUPAC2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole
SMILESCCc1nc(COc2cnc3ccccc3c2)cs1
InChIInChI=1S/C15H14N2OS/c1-2-15-17-12(10-19-15)9-18-13-7-11-5-3-4-6-14(11)16-8-13/h3-8,10H,2,9H2,1H3
InChIKeyWDNBUKDAVWSLIU-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.83
Rot. Bonds4

About 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole

2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole (PubChem CID 102846975) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole
PubChem CID102846975
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole
SMILESCCc1nc(COc2cnc3ccccc3c2)cs1
InChIInChI=1S/C15H14N2OS/c1-2-15-17-12(10-19-15)9-18-13-7-11-5-3-4-6-14(11)16-8-13/h3-8,10H,2,9H2,1H3
InChIKeyWDNBUKDAVWSLIU-UHFFFAOYSA-N
XLogP3.83
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenol
CID 61484157
4-[(4-ethoxyphenoxy)methyl]-2-ethyl-1,3-thiazole
CID 78878086
4-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-N-methylaniline
CID 55136719
4-[(4-tert-butylphenoxy)methyl]-2-ethyl-1,3-thiazole
CID 64766048
3-[(5-bromo-2-pyridinyl)methoxy]quinoline
CID 107388127
2-ethyl-4-[(4-fluoro-3-methylphenoxy)methyl]-1,3-thiazole
CID 81422379
5-ethyl-3-(quinolin-3-yloxymethyl)-1,2,4-oxadiazole
CID 102847040
1-[4-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenyl]-N-methylmethanamine
CID 54955994
3-(bromomethoxy)quinoline
CID 54277099
1-[4-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-2-fluorophenyl]ethanamine
CID 107716311
1-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-amine
CID 61484148
2-quinolin-3-yloxyethanol
CID 102847036

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole?
The IUPAC name of 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole (CID 102846975) is 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole.
What is the SMILES notation for 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole?
The canonical SMILES for 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole is CCc1nc(COc2cnc3ccccc3c2)cs1.
What is the InChIKey of 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole?
The InChIKey is WDNBUKDAVWSLIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c1-2-15-17-12(10-19-15)9-18-13-7-11-5-3-4-6-14(11)16-8-13/h3-8,10H,2,9H2,1H3.
What are the key properties of 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole?
2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole has a molecular weight of 270.36 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole is sourced from PubChem (CID 102846975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).