(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine

C15H20N2S — CID 62416854

IUPAC(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine
SMILESCCc1ccccc1C(N)c1nc(CC)c(C)s1
InChIInChI=1S/C15H20N2S/c1-4-11-8-6-7-9-12(11)14(16)15-17-13(5-2)10(3)18-15/h6-9,14H,4-5,16H2,1-3H3
InChIKeyCGLXLYHTSPWZFS-UHFFFAOYSA-N
MW260.41 g/mol
LogP3.62
Rot. Bonds4

About (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine

(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine (PubChem CID 62416854) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine.

Molecular Properties

Compound Name(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine
PubChem CID62416854
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC Name(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine
SMILESCCc1ccccc1C(N)c1nc(CC)c(C)s1
InChIInChI=1S/C15H20N2S/c1-4-11-8-6-7-9-12(11)14(16)15-17-13(5-2)10(3)18-15/h6-9,14H,4-5,16H2,1-3H3
InChIKeyCGLXLYHTSPWZFS-UHFFFAOYSA-N
XLogP3.62
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dichlorophenyl)-(4-ethyl-5-methyl-1,3-thiazol-2-yl)methanamine
CID 61330519
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3-methylbutan-1-amine
CID 61331303
(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(1-methylpyrazol-4-yl)methanamine
CID 61333083
N-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-methylphenyl)methyl]propan-2-amine
CID 61336192
(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(3-propan-2-yloxyphenyl)methanamine
CID 61331308
N-[(2-ethoxyphenyl)-(4-ethyl-5-methyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 61332177
N-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)-phenylmethyl]ethanamine
CID 61332174
(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(4-methoxy-3-methylphenyl)methanamine
CID 55039474
2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide
CID 61474639
5-[1-(2-ethylphenyl)ethyl]-4-methyl-1,3-thiazol-2-amine
CID 64707265
2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide;hydrochloride
CID 119295899
(2-ethoxyphenyl)-(2-ethylphenyl)methanamine
CID 115853715

Frequently Asked Questions

What is the IUPAC name of (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine?
The IUPAC name of (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine (CID 62416854) is (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine.
What is the SMILES notation for (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine?
The canonical SMILES for (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine is CCc1ccccc1C(N)c1nc(CC)c(C)s1.
What is the InChIKey of (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine?
The InChIKey is CGLXLYHTSPWZFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-4-11-8-6-7-9-12(11)14(16)15-17-13(5-2)10(3)18-15/h6-9,14H,4-5,16H2,1-3H3.
What are the key properties of (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine?
(4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine has a molecular weight of 260.41 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-5-methyl-1,3-thiazol-2-yl)-(2-ethylphenyl)methanamine is sourced from PubChem (CID 62416854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).