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

C10H16N2S — CID 105450241

IUPAC[1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine
SMILESCCc1csc(C2(CN)CCC2)n1
InChIInChI=1S/C10H16N2S/c1-2-8-6-13-9(12-8)10(7-11)4-3-5-10/h6H,2-5,7,11H2,1H3
InChIKeyBHRIPNASFFOJQX-UHFFFAOYSA-N
MW196.32 g/mol
LogP2.09
Rot. Bonds3

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

[1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine (PubChem CID 105450241) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine
PubChem CID105450241
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name[1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine
SMILESCCc1csc(C2(CN)CCC2)n1
InChIInChI=1S/C10H16N2S/c1-2-8-6-13-9(12-8)10(7-11)4-3-5-10/h6H,2-5,7,11H2,1H3
InChIKeyBHRIPNASFFOJQX-UHFFFAOYSA-N
XLogP2.09
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 52.09
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)cyclobutyl]methanamine?
The IUPAC name of [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine (CID 105450241) is [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine.
What is the SMILES notation for [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine?
The canonical SMILES for [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine is CCc1csc(C2(CN)CCC2)n1.
What is the InChIKey of [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine?
The InChIKey is BHRIPNASFFOJQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-2-8-6-13-9(12-8)10(7-11)4-3-5-10/h6H,2-5,7,11H2,1H3.
What are the key properties of [1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine?
[1-(4-ethyl-1,3-thiazol-2-yl)cyclobutyl]methanamine has a molecular weight of 196.32 g/mol, XLogP of 2.09, 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)cyclobutyl]methanamine is sourced from PubChem (CID 105450241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).