1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine

C14H18N2S — CID 62796349

IUPAC1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCCc1ccc(C(N)Cc2nc(C)cs2)cc1
InChIInChI=1S/C14H18N2S/c1-3-11-4-6-12(7-5-11)13(15)8-14-16-10(2)9-17-14/h4-7,9,13H,3,8,15H2,1-2H3
InChIKeySCTMJFHFNCRWOX-UHFFFAOYSA-N
MW246.38 g/mol
LogP3.26
Rot. Bonds4

About 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine

1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine (PubChem CID 62796349) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
PubChem CID62796349
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC Name1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCCc1ccc(C(N)Cc2nc(C)cs2)cc1
InChIInChI=1S/C14H18N2S/c1-3-11-4-6-12(7-5-11)13(15)8-14-16-10(2)9-17-14/h4-7,9,13H,3,8,15H2,1-2H3
InChIKeySCTMJFHFNCRWOX-UHFFFAOYSA-N
XLogP3.26
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethylphenyl)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanamine
CID 64648813
1-(4-ethylphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 54912825
1-(3-methylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 62795308
1-(5-ethylfuran-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 105019259
1-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine
CID 62796548
1-(3-iodophenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 105019204
1-(3-chlorothiophen-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 105019424
1-(4-ethylphenyl)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamine
CID 82066904
2-ethyl-4-methyl-1,3-thiazole
CID 27440
(2S)-1-(4-methyl-1,3-thiazol-2-yl)pentan-2-amine
CID 94605824
2-(4-methyl-1,3-thiazol-2-yl)-1-(2,4,5-trimethylphenyl)ethanamine
CID 64989653
1-(3-ethyl-1-methylpyrazol-5-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 105171468

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine (CID 62796349) is 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine is CCc1ccc(C(N)Cc2nc(C)cs2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The InChIKey is SCTMJFHFNCRWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c1-3-11-4-6-12(7-5-11)13(15)8-14-16-10(2)9-17-14/h4-7,9,13H,3,8,15H2,1-2H3.
What are the key properties of 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine has a molecular weight of 246.38 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 62796349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).