N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine

C8H14N2S — CID 43439575

IUPACN-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC2CC2)=N1
InChIInChI=1S/C8H14N2S/c1-2-6-5-11-8(9-6)10-7-3-4-7/h6-7H,2-5H2,1H3,(H,9,10)
InChIKeyBIAWMXXCEZEROL-UHFFFAOYSA-N
MW170.28 g/mol
LogP1.62
Rot. Bonds2

About N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine

N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43439575) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43439575
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC NameN-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC2CC2)=N1
InChIInChI=1S/C8H14N2S/c1-2-6-5-11-8(9-6)10-7-3-4-7/h6-7H,2-5H2,1H3,(H,9,10)
InChIKeyBIAWMXXCEZEROL-UHFFFAOYSA-N
XLogP1.62
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine (CID 43439575) is N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine is CCC1CSC(NC2CC2)=N1.
What is the InChIKey of N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is BIAWMXXCEZEROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-2-6-5-11-8(9-6)10-7-3-4-7/h6-7H,2-5H2,1H3,(H,9,10).
What are the key properties of N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 170.28 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43439575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).