5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine

C15H19FN2S — CID 55171604

IUPAC5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(Cc1ccc(F)cc1)NC1=NCC(C2CC2)S1
InChIInChI=1S/C15H19FN2S/c1-10(8-11-2-6-13(16)7-3-11)18-15-17-9-14(19-15)12-4-5-12/h2-3,6-7,10,12,14H,4-5,8-9H2,1H3,(H,17,18)
InChIKeyXTRIULMLZHPRIY-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.23
Rot. Bonds4

About 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine

5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 55171604) has the molecular formula C15H19FN2S and a molecular weight of 278.40 g/mol. Its IUPAC name is 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID55171604
Molecular FormulaC15H19FN2S
Molecular Weight278.40 g/mol
Exact Mass278.13
IUPAC Name5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(Cc1ccc(F)cc1)NC1=NCC(C2CC2)S1
InChIInChI=1S/C15H19FN2S/c1-10(8-11-2-6-13(16)7-3-11)18-15-17-9-14(19-15)12-4-5-12/h2-3,6-7,10,12,14H,4-5,8-9H2,1H3,(H,17,18)
InChIKeyXTRIULMLZHPRIY-UHFFFAOYSA-N
XLogP3.23
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine (CID 55171604) is 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine is CC(Cc1ccc(F)cc1)NC1=NCC(C2CC2)S1.
What is the InChIKey of 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is XTRIULMLZHPRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2S/c1-10(8-11-2-6-13(16)7-3-11)18-15-17-9-14(19-15)12-4-5-12/h2-3,6-7,10,12,14H,4-5,8-9H2,1H3,(H,17,18).
What are the key properties of 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine?
5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 278.40 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[1-(4-fluorophenyl)propan-2-yl]-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 55171604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).