3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine

C9H16N2S — CID 116884822

IUPAC3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine
SMILESCc1nc(C)c(CC(C)CN)s1
InChIInChI=1S/C9H16N2S/c1-6(5-10)4-9-7(2)11-8(3)12-9/h6H,4-5,10H2,1-3H3
InChIKeyHZFDWKRILIIOBW-UHFFFAOYSA-N
MW184.31 g/mol
LogP1.90
Rot. Bonds3

About 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine

3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine (PubChem CID 116884822) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine
PubChem CID116884822
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC Name3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine
SMILESCc1nc(C)c(CC(C)CN)s1
InChIInChI=1S/C9H16N2S/c1-6(5-10)4-9-7(2)11-8(3)12-9/h6H,4-5,10H2,1-3H3
InChIKeyHZFDWKRILIIOBW-UHFFFAOYSA-N
XLogP1.90
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[4-methyl-2-(oxan-4-yl)-1,3-thiazol-5-yl]propan-1-amine
CID 116884844
3-[2-(4-bromothiophen-2-yl)-4-methyl-1,3-thiazol-5-yl]-2-methylpropan-1-amine
CID 116884831
2-methyl-3-(2-methyl-1,3-benzothiazol-5-yl)propan-1-amine
CID 83889724
1-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-N,2-N-dimethylpropane-1,2-diamine
CID 64539742
5-(methoxymethyl)-2,4-dimethyl-1,3-thiazole
CID 58826708
2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide
CID 83624959
3-amino-1-(2,4-dimethyl-1,3-thiazol-5-yl)propane-1,2-diol
CID 170827544
2-(2,4-dimethyl-1,3-thiazol-5-yl)butan-1-amine
CID 116887192
2-(2,4-dimethyl-1,3-thiazol-5-yl)acetaldehyde
CID 87669316
2-chloro-4-methyl-5-(2-methylpropyl)-1,3-thiazole
CID 130516681
1-(2,4-dimethyl-1,3-thiazol-5-yl)ethanamine
CID 19805509
N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-methylpentan-2-amine
CID 115718378

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine?
The IUPAC name of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine (CID 116884822) is 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine?
The canonical SMILES for 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine is Cc1nc(C)c(CC(C)CN)s1.
What is the InChIKey of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine?
The InChIKey is HZFDWKRILIIOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-6(5-10)4-9-7(2)11-8(3)12-9/h6H,4-5,10H2,1-3H3.
What are the key properties of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine?
3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine has a molecular weight of 184.31 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 116884822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).