3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine

C11H18N2S — CID 80699456

IUPAC3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCc1csc(C2(N)CCC(C)(C)C2)n1
InChIInChI=1S/C11H18N2S/c1-8-6-14-9(13-8)11(12)5-4-10(2,3)7-11/h6H,4-5,7,12H2,1-3H3
InChIKeyQKUZXNXISVPLAN-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.82
Rot. Bonds1

About 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine

3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine (PubChem CID 80699456) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
PubChem CID80699456
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCc1csc(C2(N)CCC(C)(C)C2)n1
InChIInChI=1S/C11H18N2S/c1-8-6-14-9(13-8)11(12)5-4-10(2,3)7-11/h6H,4-5,7,12H2,1-3H3
InChIKeyQKUZXNXISVPLAN-UHFFFAOYSA-N
XLogP2.82
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine (CID 80699456) is 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine is Cc1csc(C2(N)CCC(C)(C)C2)n1.
What is the InChIKey of 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
The InChIKey is QKUZXNXISVPLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-6-14-9(13-8)11(12)5-4-10(2,3)7-11/h6H,4-5,7,12H2,1-3H3.
What are the key properties of 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine has a molecular weight of 210.35 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 80699456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).