5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine

C14H17FN4S — CID 174514403

IUPAC5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine
SMILESNc1nc(NC2CCNCC2)sc1-c1ccccc1F
InChIInChI=1S/C14H17FN4S/c15-11-4-2-1-3-10(11)12-13(16)19-14(20-12)18-9-5-7-17-8-6-9/h1-4,9,17H,5-8,16H2,(H,18,19)
InChIKeyFBVOMNYOUMAMRH-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.70
Rot. Bonds3

About 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine

5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine (PubChem CID 174514403) has the molecular formula C14H17FN4S and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine.

Molecular Properties

Compound Name5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine
PubChem CID174514403
Molecular FormulaC14H17FN4S
Molecular Weight292.38 g/mol
Exact Mass292.12
IUPAC Name5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine
SMILESNc1nc(NC2CCNCC2)sc1-c1ccccc1F
InChIInChI=1S/C14H17FN4S/c15-11-4-2-1-3-10(11)12-13(16)19-14(20-12)18-9-5-7-17-8-6-9/h1-4,9,17H,5-8,16H2,(H,18,19)
InChIKeyFBVOMNYOUMAMRH-UHFFFAOYSA-N
XLogP2.70
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine?
The IUPAC name of 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine (CID 174514403) is 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine.
What is the SMILES notation for 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine?
The canonical SMILES for 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine is Nc1nc(NC2CCNCC2)sc1-c1ccccc1F.
What is the InChIKey of 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine?
The InChIKey is FBVOMNYOUMAMRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4S/c15-11-4-2-1-3-10(11)12-13(16)19-14(20-12)18-9-5-7-17-8-6-9/h1-4,9,17H,5-8,16H2,(H,18,19).
What are the key properties of 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine?
5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine has a molecular weight of 292.38 g/mol, XLogP of 2.70, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine is sourced from PubChem (CID 174514403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).