1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine

C13H22N2S — CID 116968800

IUPAC1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)Cc1nc(C2CCCC2)cs1
InChIInChI=1S/C13H22N2S/c1-13(2,14-3)8-12-15-11(9-16-12)10-6-4-5-7-10/h9-10,14H,4-8H2,1-3H3
InChIKeyHQLNMXOGLHCAGR-UHFFFAOYSA-N
MW238.40 g/mol
LogP3.34
Rot. Bonds4

About 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine

1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine (PubChem CID 116968800) has the molecular formula C13H22N2S and a molecular weight of 238.40 g/mol. Its IUPAC name is 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound Name1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine
PubChem CID116968800
Molecular FormulaC13H22N2S
Molecular Weight238.40 g/mol
Exact Mass238.15
IUPAC Name1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)Cc1nc(C2CCCC2)cs1
InChIInChI=1S/C13H22N2S/c1-13(2,14-3)8-12-15-11(9-16-12)10-6-4-5-7-10/h9-10,14H,4-8H2,1-3H3
InChIKeyHQLNMXOGLHCAGR-UHFFFAOYSA-N
XLogP3.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-1-[4-(oxan-4-yl)-1,3-thiazol-2-yl]propan-2-amine
CID 116968802
4-(4-cyclobutyl-1,3-thiazol-2-yl)-3,3-dimethylbutanoic acid
CID 116968718
2-(bromomethyl)-4-cyclopentyl-1,3-thiazole
CID 116970375
4-cyclohexyl-2-propyl-1,3-thiazole
CID 130157916
3-(4-cyclohexyl-1,3-thiazol-2-yl)-2-(methylamino)propanoic acid
CID 116969836
3-[(4-cyclobutyl-1,3-thiazol-2-yl)methyl]-N-methylaniline
CID 116968523
N-[2-(4-cyclohexyl-1,3-thiazol-2-yl)ethyl]-2-(methylamino)acetamide
CID 120704485
2-(2-chloroethyl)-4-cyclobutyl-1,3-thiazole
CID 116965575
2-(4-cyclohexyl-1,3-thiazol-2-yl)propan-2-amine
CID 61338039
4-(4-cyclohexyl-1,3-thiazol-2-yl)butan-1-ol
CID 116968668
2-(4-cyclobutyl-1,3-thiazol-2-yl)acetonitrile
CID 116966310
2-(2,2-dimethylpropyl)-4-[(2R)-pyrrolidin-2-yl]-1,3-thiazole
CID 104853395

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine?
The IUPAC name of 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine (CID 116968800) is 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine.
What is the SMILES notation for 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine?
The canonical SMILES for 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine is CNC(C)(C)Cc1nc(C2CCCC2)cs1.
What is the InChIKey of 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine?
The InChIKey is HQLNMXOGLHCAGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2S/c1-13(2,14-3)8-12-15-11(9-16-12)10-6-4-5-7-10/h9-10,14H,4-8H2,1-3H3.
What are the key properties of 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine?
1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine has a molecular weight of 238.40 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentyl-1,3-thiazol-2-yl)-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 116968800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).