2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine

C13H16N2S — CID 62082566

IUPAC2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine
SMILESCc1nc(CC(C)c2ccccc2)c(N)s1
InChIInChI=1S/C13H16N2S/c1-9(11-6-4-3-5-7-11)8-12-13(14)16-10(2)15-12/h3-7,9H,8,14H2,1-2H3
InChIKeyFWTPQRMORRJIFG-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.38
Rot. Bonds3

About 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine

2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine (PubChem CID 62082566) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine
PubChem CID62082566
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC Name2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine
SMILESCc1nc(CC(C)c2ccccc2)c(N)s1
InChIInChI=1S/C13H16N2S/c1-9(11-6-4-3-5-7-11)8-12-13(14)16-10(2)15-12/h3-7,9H,8,14H2,1-2H3
InChIKeyFWTPQRMORRJIFG-UHFFFAOYSA-N
XLogP3.38
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-Phenylpropyl)-4-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole
CID 169259953
4-Methyl-2-(3-phenylpropyl)-5-pyrrolidin-1-yl-1,3-thiazole
CID 169259988
4-Methyl-2-(3-phenylpropyl)-5-piperidin-1-yl-1,3-thiazole
CID 169260080
4-Methyl-2-(2-phenylethyl)-5-pyrrolidin-1-yl-1,3-thiazole
CID 169260108
5-[(3R)-3-fluoropyrrolidin-1-yl]-4-methyl-2-(3-phenylpropyl)-1,3-thiazole
CID 169260178
4-Methyl-2-phenyl-1,3-thiazol-5-amine
CID 62076990
[2-(2-Phenylethyl)-1,3-thiazol-4-yl]methanamine
CID 61385591
4-Tert-butyl-2-phenyl-1,3-thiazol-5-amine
CID 62077499
(2-Methyl-1,3-thiazol-4-yl)(phenyl)acetonitrile
CID 2991085
2-(Ethylsulfanyl)-4-phenyl-1,3-thiazol-5-amine
CID 25808448
2,4-Diphenyl-5-thiazolamine
CID 11680405
2,4-Dimethyl-5-phenyl-1,3-thiazole
CID 12737256

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine?
The IUPAC name of 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine (CID 62082566) is 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine is Cc1nc(CC(C)c2ccccc2)c(N)s1.
What is the InChIKey of 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine?
The InChIKey is FWTPQRMORRJIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-9(11-6-4-3-5-7-11)8-12-13(14)16-10(2)15-12/h3-7,9H,8,14H2,1-2H3.
What are the key properties of 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine?
2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine has a molecular weight of 232.35 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(2-phenylpropyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 62082566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).