1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine

C10H16N2S — CID 61331332

IUPAC1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine
SMILESCNC1(c2nc(C)c(C)s2)CCC1
InChIInChI=1S/C10H16N2S/c1-7-8(2)13-9(12-7)10(11-3)5-4-6-10/h11H,4-6H2,1-3H3
InChIKeyZOSFFIVYKMKLST-UHFFFAOYSA-N
MW196.32 g/mol
LogP2.36
Rot. Bonds2

About 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine (PubChem CID 61331332) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine.

Molecular Properties

Compound Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine
PubChem CID61331332
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine
SMILESCNC1(c2nc(C)c(C)s2)CCC1
InChIInChI=1S/C10H16N2S/c1-7-8(2)13-9(12-7)10(11-3)5-4-6-10/h11H,4-6H2,1-3H3
InChIKeyZOSFFIVYKMKLST-UHFFFAOYSA-N
XLogP2.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine?
The IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine (CID 61331332) is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine.
What is the SMILES notation for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine?
The canonical SMILES for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine is CNC1(c2nc(C)c(C)s2)CCC1.
What is the InChIKey of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine?
The InChIKey is ZOSFFIVYKMKLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-7-8(2)13-9(12-7)10(11-3)5-4-6-10/h11H,4-6H2,1-3H3.
What are the key properties of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine?
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine has a molecular weight of 196.32 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine is sourced from PubChem (CID 61331332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).