2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine

C11H18N2S — CID 107925925

IUPAC2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine
SMILESCC(C)(N)c1csc(C2CC2(C)C)n1
InChIInChI=1S/C11H18N2S/c1-10(2)5-7(10)9-13-8(6-14-9)11(3,4)12/h6-7H,5,12H2,1-4H3
InChIKeyRAVMLENULPAVFJ-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.85
Rot. Bonds2

About 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine

2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine (PubChem CID 107925925) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine.

Molecular Properties

Compound Name2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine
PubChem CID107925925
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine
SMILESCC(C)(N)c1csc(C2CC2(C)C)n1
InChIInChI=1S/C11H18N2S/c1-10(2)5-7(10)9-13-8(6-14-9)11(3,4)12/h6-7H,5,12H2,1-4H3
InChIKeyRAVMLENULPAVFJ-UHFFFAOYSA-N
XLogP2.85
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]ethanamine
CID 82670376
3-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]butan-2-amine
CID 107925920
[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]methanol
CID 107924752
4-(4-bromophenyl)-2-(2,2-dimethylcyclopropyl)-1,3-thiazole
CID 107924759
2-(2,2-dimethylcyclopropyl)-4-(methoxymethyl)-1,3-thiazole
CID 107924795
5-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]thiophene-3-carboxylic acid
CID 114016544
ethyl 2-(2,2-dimethylcyclopropyl)-1,3-thiazole-4-carboxylate
CID 107925303
methyl 2-(2,2-dimethylcyclopropyl)-1,3-thiazole-4-carboxylate
CID 107925304
N-[[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]methyl]propan-2-amine
CID 107925558
2-chloro-1-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]ethanone
CID 107925301
2-[2-(trifluoromethyl)-1,3-thiazol-4-yl]propan-2-amine
CID 96864974
2-[2-(4-methylcyclohexyl)-1,3-thiazol-4-yl]propan-2-ol
CID 121449499

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine?
The IUPAC name of 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine (CID 107925925) is 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine.
What is the SMILES notation for 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine?
The canonical SMILES for 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine is CC(C)(N)c1csc(C2CC2(C)C)n1.
What is the InChIKey of 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine?
The InChIKey is RAVMLENULPAVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-10(2)5-7(10)9-13-8(6-14-9)11(3,4)12/h6-7H,5,12H2,1-4H3.
What are the key properties of 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine?
2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine has a molecular weight of 210.35 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]propan-2-amine is sourced from PubChem (CID 107925925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).