1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine

C15H19FN2S — CID 79824475

IUPAC1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
SMILESCCCNC(Cc1nccs1)Cc1ccccc1F
InChIInChI=1S/C15H19FN2S/c1-2-7-17-13(11-15-18-8-9-19-15)10-12-5-3-4-6-14(12)16/h3-6,8-9,13,17H,2,7,10-11H2,1H3
InChIKeyJXGLSSQWIINPOD-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.44
Rot. Bonds7

About 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine

1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine (PubChem CID 79824475) has the molecular formula C15H19FN2S and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
PubChem CID79824475
Molecular FormulaC15H19FN2S
Molecular Weight278.40 g/mol
Exact Mass278.13
IUPAC Name1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
SMILESCCCNC(Cc1nccs1)Cc1ccccc1F
InChIInChI=1S/C15H19FN2S/c1-2-7-17-13(11-15-18-8-9-19-15)10-12-5-3-4-6-14(12)16/h3-6,8-9,13,17H,2,7,10-11H2,1H3
InChIKeyJXGLSSQWIINPOD-UHFFFAOYSA-N
XLogP3.44
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dichlorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79824912
1-(2-bromophenyl)-3-(2-fluorophenyl)-N-propylpropan-2-amine
CID 63417230
N-propyl-1-(1,3-thiazol-2-yl)-3-thiophen-3-ylpropan-2-amine
CID 105169161
1-(2-fluorophenyl)-N-propyl-4-pyridin-2-ylbutan-2-amine
CID 105090087
1-(2-fluorophenyl)-4,4-dimethyl-N-propylpentan-2-amine
CID 61066309
1-(3-chlorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79823913
1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine
CID 113391483
1-(2-fluorophenyl)-3-methylsulfonyl-N-propylpropan-2-amine
CID 62472909
N-propyl-1-(1,3-thiazol-2-yl)undecan-2-amine
CID 105015117
N-propyl-1-(1,3-thiazol-2-yl)decan-2-amine
CID 105014908
1-(3-methoxyphenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79824474
4-(furan-2-yl)-N-propyl-1-(1,3-thiazol-2-yl)butan-2-amine
CID 105169314

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine (CID 79824475) is 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine is CCCNC(Cc1nccs1)Cc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine?
The InChIKey is JXGLSSQWIINPOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2S/c1-2-7-17-13(11-15-18-8-9-19-15)10-12-5-3-4-6-14(12)16/h3-6,8-9,13,17H,2,7,10-11H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine?
1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine has a molecular weight of 278.40 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine is sourced from PubChem (CID 79824475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).