2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole

C14H15N3OS — CID 10084685

IUPAC2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole
SMILESCc1csc(-c2ccccc2OCC2=NCCN2)n1
InChIInChI=1S/C14H15N3OS/c1-10-9-19-14(17-10)11-4-2-3-5-12(11)18-8-13-15-6-7-16-13/h2-5,9H,6-8H2,1H3,(H,15,16)
InChIKeyBWPVUBRWPURGHZ-UHFFFAOYSA-N
MW273.36 g/mol
LogP2.50
Rot. Bonds4

About 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole

2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole (PubChem CID 10084685) has the molecular formula C14H15N3OS and a molecular weight of 273.36 g/mol. Its IUPAC name is 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole
PubChem CID10084685
Molecular FormulaC14H15N3OS
Molecular Weight273.36 g/mol
Exact Mass273.09
IUPAC Name2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole
SMILESCc1csc(-c2ccccc2OCC2=NCCN2)n1
InChIInChI=1S/C14H15N3OS/c1-10-9-19-14(17-10)11-4-2-3-5-12(11)18-8-13-15-6-7-16-13/h2-5,9H,6-8H2,1H3,(H,15,16)
InChIKeyBWPVUBRWPURGHZ-UHFFFAOYSA-N
XLogP2.50
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Methylsulfanyl-4-(4-phenoxymethyl-thiazol-2-yl)-thiophene-2-carboxamidine
CID 18537342
4-[4-(4-Fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]morpholine
CID 118310056
(Z)-3-fluoro-2-[[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]methyl]prop-2-en-1-amine
CID 146427577
(E)-3-fluoro-2-[[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]methyl]prop-2-en-1-amine
CID 146512035
2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1,3-thiazole
CID 44362196
{[2-(4-Ethoxyphenyl)-1,3-thiazol-4-yl]methyl}[2-(4-fluorophenyl)ethyl]amine
CID 9515026
4-[4-(2-Methoxyphenyl)-1,3-thiazol-2-yl]piperidine hydrobromide
CID 68465550
1-(2,3-Dihydro-1-benzofuran-3-yl)-3-[[2-(dimethylamino)-1,3-thiazol-4-yl]methyl]urea
CID 71865029
N-[(2-methoxyphenyl)methyl]-1-(4-methyl-1,3-thiazol-2-yl)-2-thiophen-2-ylethanamine
CID 110221756
N-(4,5-dihydro-1H-imidazol-2-yl)-4-[2-(2,4-dimethylphenoxy)phenyl]-1,3-thiazol-2-amine
CID 166629295
(2-(4-Methoxyphenyl)thiazol-4-yl)methanamine
CID 16494949
3-[4-(2-Methoxyphenyl)-1,3-thiazol-2-yl]piperidine hydrobromide
CID 86811785

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole?
The IUPAC name of 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole (CID 10084685) is 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole.
What is the SMILES notation for 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole?
The canonical SMILES for 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole is Cc1csc(-c2ccccc2OCC2=NCCN2)n1.
What is the InChIKey of 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole?
The InChIKey is BWPVUBRWPURGHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3OS/c1-10-9-19-14(17-10)11-4-2-3-5-12(11)18-8-13-15-6-7-16-13/h2-5,9H,6-8H2,1H3,(H,15,16).
What are the key properties of 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole?
2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole has a molecular weight of 273.36 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-4-methyl-1,3-thiazole is sourced from PubChem (CID 10084685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).