[1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine

C11H18N2S — CID 83703000

IUPAC[1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine
SMILESCCc1csc(C2(CN)CCCC2)n1
InChIInChI=1S/C11H18N2S/c1-2-9-7-14-10(13-9)11(8-12)5-3-4-6-11/h7H,2-6,8,12H2,1H3
InChIKeyVUZYFRSIKGHDGW-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.48
Rot. Bonds3

About [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine

[1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine (PubChem CID 83703000) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine
PubChem CID83703000
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name[1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine
SMILESCCc1csc(C2(CN)CCCC2)n1
InChIInChI=1S/C11H18N2S/c1-2-9-7-14-10(13-9)11(8-12)5-3-4-6-11/h7H,2-6,8,12H2,1H3
InChIKeyVUZYFRSIKGHDGW-UHFFFAOYSA-N
XLogP2.48
TPSA38.91 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 ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine?
The IUPAC name of [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine (CID 83703000) is [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine?
The canonical SMILES for [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine is CCc1csc(C2(CN)CCCC2)n1.
What is the InChIKey of [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine?
The InChIKey is VUZYFRSIKGHDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-2-9-7-14-10(13-9)11(8-12)5-3-4-6-11/h7H,2-6,8,12H2,1H3.
What are the key properties of [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine?
[1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine has a molecular weight of 210.35 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethyl-1,3-thiazol-2-yl)cyclopentyl]methanamine is sourced from PubChem (CID 83703000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).