2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine

C16H19FN4 — CID 83269671

IUPAC2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine
SMILESCc1cnc(N2CCN(c3ccccc3F)CC2)cc1N
InChIInChI=1S/C16H19FN4/c1-12-11-19-16(10-14(12)18)21-8-6-20(7-9-21)15-5-3-2-4-13(15)17/h2-5,10-11H,6-9H2,1H3,(H2,18,19)
InChIKeyMXPYYYYRDMGCGU-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.44
Rot. Bonds2

About 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine

2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine (PubChem CID 83269671) has the molecular formula C16H19FN4 and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine.

Molecular Properties

Compound Name2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine
PubChem CID83269671
Molecular FormulaC16H19FN4
Molecular Weight286.35 g/mol
Exact Mass286.16
IUPAC Name2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine
SMILESCc1cnc(N2CCN(c3ccccc3F)CC2)cc1N
InChIInChI=1S/C16H19FN4/c1-12-11-19-16(10-14(12)18)21-8-6-20(7-9-21)15-5-3-2-4-13(15)17/h2-5,10-11H,6-9H2,1H3,(H2,18,19)
InChIKeyMXPYYYYRDMGCGU-UHFFFAOYSA-N
XLogP2.44
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-(2-fluorophenyl)piperazin-1-yl]pyridin-3-amine
CID 9161640
4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidine
CID 163351970
6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-amine
CID 78929785
4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(4-methylpiperazin-1-yl)pyrimidine
CID 112857944
2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine
CID 83265203
6-[4-(2-fluorophenyl)piperazin-1-yl]-3-methylpyrimidin-4-one
CID 171334290
4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(2-methylimidazol-1-yl)pyrimidine
CID 154829213
4-[4-(2-fluorophenyl)piperazin-1-yl]-6-phenylpyrimidine
CID 35271779
2-chloro-4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidine
CID 62483420
4,6-bis[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-5-amine
CID 19153662
4-(2-fluorophenoxy)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidine
CID 83289222
ethyl N-[6-[4-(2-fluorophenyl)piperazin-1-yl]-3-pyridinyl]carbamate
CID 113014423

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine?
The IUPAC name of 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine (CID 83269671) is 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine.
What is the SMILES notation for 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine?
The canonical SMILES for 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine is Cc1cnc(N2CCN(c3ccccc3F)CC2)cc1N.
What is the InChIKey of 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine?
The InChIKey is MXPYYYYRDMGCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4/c1-12-11-19-16(10-14(12)18)21-8-6-20(7-9-21)15-5-3-2-4-13(15)17/h2-5,10-11H,6-9H2,1H3,(H2,18,19).
What are the key properties of 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine?
2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine has a molecular weight of 286.35 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylpyridin-4-amine is sourced from PubChem (CID 83269671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).