[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine

C13H17N3OS — CID 103175647

IUPAC[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine
SMILESCCc1nc(C)ccc1OCc1csc(CN)n1
InChIInChI=1S/C13H17N3OS/c1-3-11-12(5-4-9(2)15-11)17-7-10-8-18-13(6-14)16-10/h4-5,8H,3,6-7,14H2,1-2H3
InChIKeyZWYLHQWQFBQQGR-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.45
Rot. Bonds5

About [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine

[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine (PubChem CID 103175647) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine
PubChem CID103175647
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine
SMILESCCc1nc(C)ccc1OCc1csc(CN)n1
InChIInChI=1S/C13H17N3OS/c1-3-11-12(5-4-9(2)15-11)17-7-10-8-18-13(6-14)16-10/h4-5,8H,3,6-7,14H2,1-2H3
InChIKeyZWYLHQWQFBQQGR-UHFFFAOYSA-N
XLogP2.45
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine with MolForge

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Related Compounds

[6-methyl-3-[(2-propyl-1,3-thiazol-4-yl)methoxy]-2-pyridinyl]methanamine
CID 79150632
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-amine
CID 103174470
[4-[[2-(trifluoromethyl)phenoxy]methyl]-1,3-thiazol-2-yl]methanamine;hydrochloride
CID 159339368
[4-(ethoxymethyl)-1,3-thiazol-2-yl]methanamine
CID 62445438
[4-[[4-(2-methylbutan-2-yl)phenoxy]methyl]-1,3-thiazol-2-yl]methanamine
CID 62452340
[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methanamine
CID 103175605
(1R)-1-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-5-methylphenyl]ethanamine
CID 55190625
[4-[(1-methyl-1,2,4-triazol-3-yl)oxymethyl]-1,3-thiazol-2-yl]methanamine
CID 106598242
[4-[(4-propylphenoxy)methyl]-1,3-thiazol-2-yl]methanamine
CID 62548421
2-[2-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-5-fluorophenyl]ethanamine
CID 107700129
[2-chloro-6-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenyl]methanamine
CID 114318303
3-[(2-ethyl-1,3-thiazol-4-yl)methoxy]-4-methylbenzoic acid
CID 60722313

Frequently Asked Questions

What is the IUPAC name of [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine?
The IUPAC name of [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine (CID 103175647) is [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine.
What is the SMILES notation for [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine?
The canonical SMILES for [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine is CCc1nc(C)ccc1OCc1csc(CN)n1.
What is the InChIKey of [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine?
The InChIKey is ZWYLHQWQFBQQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-3-11-12(5-4-9(2)15-11)17-7-10-8-18-13(6-14)16-10/h4-5,8H,3,6-7,14H2,1-2H3.
What are the key properties of [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine?
[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine has a molecular weight of 263.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine is sourced from PubChem (CID 103175647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).