2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine

C17H24N2S — CID 62543216

IUPAC2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine
SMILESCC(C)c1sc(CNC(C)(C)C)nc1-c1ccccc1
InChIInChI=1S/C17H24N2S/c1-12(2)16-15(13-9-7-6-8-10-13)19-14(20-16)11-18-17(3,4)5/h6-10,12,18H,11H2,1-5H3
InChIKeyLMZDPCMJEQXJLQ-UHFFFAOYSA-N
MW288.46 g/mol
LogP4.82
Rot. Bonds4

About 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine

2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine (PubChem CID 62543216) has the molecular formula C17H24N2S and a molecular weight of 288.46 g/mol. Its IUPAC name is 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine
PubChem CID62543216
Molecular FormulaC17H24N2S
Molecular Weight288.46 g/mol
Exact Mass288.17
IUPAC Name2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine
SMILESCC(C)c1sc(CNC(C)(C)C)nc1-c1ccccc1
InChIInChI=1S/C17H24N2S/c1-12(2)16-15(13-9-7-6-8-10-13)19-14(20-16)11-18-17(3,4)5/h6-10,12,18H,11H2,1-5H3
InChIKeyLMZDPCMJEQXJLQ-UHFFFAOYSA-N
XLogP4.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine with MolForge

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Related Compounds

2-(chloromethyl)-4-phenyl-5-propan-2-yl-1,3-thiazole
CID 62921644
2-tert-butyl-4-phenyl-5-propan-2-yl-1,3-thiazole;ethane
CID 170587640
N-(2-methylpropyl)-4-phenyl-5-propan-2-yl-1,3-thiazol-2-amine
CID 63470536
N-[(2-tert-butyl-4-phenyl-1,3-thiazol-5-yl)methyl]-2-methylpropan-2-amine
CID 81178207
4-phenyl-5-propan-2-yl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 62540204
N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 104513428
N-[(4,5-diphenyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 154194483
5-methyl-2-[2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)ethyl]-4-phenyl-1,3-thiazole
CID 2129747
N-[[2-(2,2-dimethylpropyl)-4-phenyl-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 81178307
2-methyl-N-[2-(4-phenyl-2-propyl-1,3-thiazol-5-yl)ethyl]propan-2-amine
CID 79782920
[4-(3-fluorophenyl)-5-propan-2-yl-1,3-thiazol-2-yl]methanamine
CID 82106665
2-(5-propan-2-yl-4-pyridin-4-yl-1,3-thiazol-2-yl)ethanamine
CID 82106871

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine (CID 62543216) is 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine is CC(C)c1sc(CNC(C)(C)C)nc1-c1ccccc1.
What is the InChIKey of 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine?
The InChIKey is LMZDPCMJEQXJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2S/c1-12(2)16-15(13-9-7-6-8-10-13)19-14(20-16)11-18-17(3,4)5/h6-10,12,18H,11H2,1-5H3.
What are the key properties of 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine?
2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine has a molecular weight of 288.46 g/mol, XLogP of 4.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 62543216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).