4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine

C8H12N2S — CID 62956632

IUPAC4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine
SMILESCCNc1nc(C2CC2)cs1
InChIInChI=1S/C8H12N2S/c1-2-9-8-10-7(5-11-8)6-3-4-6/h5-6H,2-4H2,1H3,(H,9,10)
InChIKeyZVCKFXZPNLMKHR-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.45
Rot. Bonds3

About 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine

4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine (PubChem CID 62956632) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine
PubChem CID62956632
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC Name4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine
SMILESCCNc1nc(C2CC2)cs1
InChIInChI=1S/C8H12N2S/c1-2-9-8-10-7(5-11-8)6-3-4-6/h5-6H,2-4H2,1H3,(H,9,10)
InChIKeyZVCKFXZPNLMKHR-UHFFFAOYSA-N
XLogP2.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine?
The IUPAC name of 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine (CID 62956632) is 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine is CCNc1nc(C2CC2)cs1.
What is the InChIKey of 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine?
The InChIKey is ZVCKFXZPNLMKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S/c1-2-9-8-10-7(5-11-8)6-3-4-6/h5-6H,2-4H2,1H3,(H,9,10).
What are the key properties of 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine?
4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine has a molecular weight of 168.26 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-ethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 62956632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).