4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine

C15H20N2S — CID 55027261

IUPAC4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
SMILESCc1ccc(-c2csc(NCC(C)C)n2)c(C)c1
InChIInChI=1S/C15H20N2S/c1-10(2)8-16-15-17-14(9-18-15)13-6-5-11(3)7-12(13)4/h5-7,9-10H,8H2,1-4H3,(H,16,17)
InChIKeyLTIDKPUONYSEPS-UHFFFAOYSA-N
MW260.41 g/mol
LogP4.49
Rot. Bonds4

About 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine

4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine (PubChem CID 55027261) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
PubChem CID55027261
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC Name4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
SMILESCc1ccc(-c2csc(NCC(C)C)n2)c(C)c1
InChIInChI=1S/C15H20N2S/c1-10(2)8-16-15-17-14(9-18-15)13-6-5-11(3)7-12(13)4/h5-7,9-10H,8H2,1-4H3,(H,16,17)
InChIKeyLTIDKPUONYSEPS-UHFFFAOYSA-N
XLogP4.49
TPSA24.92 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 ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-dimethylphenyl)-N-prop-2-enyl-1,3-thiazol-2-amine
CID 2059129
4-(2,4-dimethylphenyl)-N-methyl-1,3-thiazol-2-amine
CID 17465165
4-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 8962177
N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-methylpropanamide
CID 3627689
4-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)-1,3-thiazol-2-amine
CID 17473672
N-(2-methylpropyl)-4-(3-methylthiophen-2-yl)-1,3-thiazol-2-amine
CID 63992614
4-N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]benzene-1,4-diamine
CID 82059186
1-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-methylpropan-2-amine
CID 116964953
4-(1,3-dimethylpyrazol-4-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 63931625
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-methylpropan-1-amine
CID 116965093
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]butan-1-ol
CID 82121806
1-amino-N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]cyclopropane-1-carboxamide
CID 119685811

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine (CID 55027261) is 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine is Cc1ccc(-c2csc(NCC(C)C)n2)c(C)c1.
What is the InChIKey of 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
The InChIKey is LTIDKPUONYSEPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-10(2)8-16-15-17-14(9-18-15)13-6-5-11(3)7-12(13)4/h5-7,9-10H,8H2,1-4H3,(H,16,17).
What are the key properties of 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine has a molecular weight of 260.41 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 55027261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).