4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine

C13H15FN2OS — CID 4883716

IUPAC4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
SMILESCOCC(C)Nc1nc(-c2ccccc2F)cs1
InChIInChI=1S/C13H15FN2OS/c1-9(7-17-2)15-13-16-12(8-18-13)10-5-3-4-6-11(10)14/h3-6,8-9H,7H2,1-2H3,(H,15,16)
InChIKeyWPYUHHXPTMPTSR-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.40
Rot. Bonds5

About 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine

4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine (PubChem CID 4883716) has the molecular formula C13H15FN2OS and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
PubChem CID4883716
Molecular FormulaC13H15FN2OS
Molecular Weight266.34 g/mol
Exact Mass266.09
IUPAC Name4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
SMILESCOCC(C)Nc1nc(-c2ccccc2F)cs1
InChIInChI=1S/C13H15FN2OS/c1-9(7-17-2)15-13-16-12(8-18-13)10-5-3-4-6-11(10)14/h3-6,8-9H,7H2,1-2H3,(H,15,16)
InChIKeyWPYUHHXPTMPTSR-UHFFFAOYSA-N
XLogP3.40
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine (CID 4883716) is 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine is COCC(C)Nc1nc(-c2ccccc2F)cs1.
What is the InChIKey of 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
The InChIKey is WPYUHHXPTMPTSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2OS/c1-9(7-17-2)15-13-16-12(8-18-13)10-5-3-4-6-11(10)14/h3-6,8-9H,7H2,1-2H3,(H,15,16).
What are the key properties of 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine has a molecular weight of 266.34 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 4883716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).