N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine

C11H18N2S — CID 79823752

IUPACN,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
SMILESCNC1CCC(Cc2nccs2)C1C
InChIInChI=1S/C11H18N2S/c1-8-9(3-4-10(8)12-2)7-11-13-5-6-14-11/h5-6,8-10,12H,3-4,7H2,1-2H3
InChIKeyHKKNCUHKRYHPML-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.32
Rot. Bonds3

About N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine

N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine (PubChem CID 79823752) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
PubChem CID79823752
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC NameN,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
SMILESCNC1CCC(Cc2nccs2)C1C
InChIInChI=1S/C11H18N2S/c1-8-9(3-4-10(8)12-2)7-11-13-5-6-14-11/h5-6,8-10,12H,3-4,7H2,1-2H3
InChIKeyHKKNCUHKRYHPML-UHFFFAOYSA-N
XLogP2.32
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
The IUPAC name of N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine (CID 79823752) is N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine is CNC1CCC(Cc2nccs2)C1C.
What is the InChIKey of N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
The InChIKey is HKKNCUHKRYHPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-9(3-4-10(8)12-2)7-11-13-5-6-14-11/h5-6,8-10,12H,3-4,7H2,1-2H3.
What are the key properties of N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine has a molecular weight of 210.35 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 79823752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).