2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine

C15H20N2S — CID 82484829

IUPAC2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine
SMILESCc1ccc(C(C)C)cc1-c1nc(CCN)cs1
InChIInChI=1S/C15H20N2S/c1-10(2)12-5-4-11(3)14(8-12)15-17-13(6-7-16)9-18-15/h4-5,8-10H,6-7,16H2,1-3H3
InChIKeyPJOPNSPJNZMCIZ-UHFFFAOYSA-N
MW260.41 g/mol
LogP3.74
Rot. Bonds4

About 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine

2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine (PubChem CID 82484829) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine
PubChem CID82484829
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC Name2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine
SMILESCc1ccc(C(C)C)cc1-c1nc(CCN)cs1
InChIInChI=1S/C15H20N2S/c1-10(2)12-5-4-11(3)14(8-12)15-17-13(6-7-16)9-18-15/h4-5,8-10H,6-7,16H2,1-3H3
InChIKeyPJOPNSPJNZMCIZ-UHFFFAOYSA-N
XLogP3.74
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 ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazole
CID 116892221
2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazole-4-carboxamide
CID 116891994
2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethanamine
CID 3799257
4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 82495942
[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanamine
CID 82482338
3-[2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-yl]propan-1-amine
CID 116888287
2-[5-(2-methoxy-5-propan-2-ylphenyl)-1,2-oxazol-3-yl]ethanamine
CID 96665567
2-[5-methyl-4-(2-methyl-5-propan-2-ylphenyl)-1H-imidazol-2-yl]ethanamine
CID 82483196
4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]butan-2-amine
CID 116888422
2-(bromomethyl)-4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazole
CID 116970332
2-[2-(2-methyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]ethanamine
CID 130512401
4,5-dimethyl-2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazole
CID 116887657

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine?
The IUPAC name of 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine (CID 82484829) is 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine.
What is the SMILES notation for 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine?
The canonical SMILES for 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine is Cc1ccc(C(C)C)cc1-c1nc(CCN)cs1.
What is the InChIKey of 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine?
The InChIKey is PJOPNSPJNZMCIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-10(2)12-5-4-11(3)14(8-12)15-17-13(6-7-16)9-18-15/h4-5,8-10H,6-7,16H2,1-3H3.
What are the key properties of 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine?
2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine has a molecular weight of 260.41 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethanamine is sourced from PubChem (CID 82484829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).