5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine

C10H18N2S — CID 22980760

IUPAC5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine
SMILESCNc1nc(C)c(CC(C)(C)C)s1
InChIInChI=1S/C10H18N2S/c1-7-8(6-10(2,3)4)13-9(11-5)12-7/h6H2,1-5H3,(H,11,12)
InChIKeyJWSNIMGKNCJEGW-UHFFFAOYSA-N
MW198.33 g/mol
LogP3.08
Rot. Bonds2

About 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine

5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine (PubChem CID 22980760) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine
PubChem CID22980760
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC Name5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine
SMILESCNc1nc(C)c(CC(C)(C)C)s1
InChIInChI=1S/C10H18N2S/c1-7-8(6-10(2,3)4)13-9(11-5)12-7/h6H2,1-5H3,(H,11,12)
InChIKeyJWSNIMGKNCJEGW-UHFFFAOYSA-N
XLogP3.08
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine (CID 22980760) is 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine is CNc1nc(C)c(CC(C)(C)C)s1.
What is the InChIKey of 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine?
The InChIKey is JWSNIMGKNCJEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-7-8(6-10(2,3)4)13-9(11-5)12-7/h6H2,1-5H3,(H,11,12).
What are the key properties of 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine?
5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine has a molecular weight of 198.33 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 22980760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).