4-fluoro-6-piperidin-1-ylpyrimidin-2-amine

C9H13FN4 — CID 676639

IUPAC4-fluoro-6-piperidin-1-ylpyrimidin-2-amine
SMILESNc1nc(F)cc(N2CCCCC2)n1
InChIInChI=1S/C9H13FN4/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,12,13)
InChIKeyJHOMLXZSDLLBFN-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.19
Rot. Bonds1

About 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine

4-fluoro-6-piperidin-1-ylpyrimidin-2-amine (PubChem CID 676639) has the molecular formula C9H13FN4 and a molecular weight of 196.23 g/mol. Its IUPAC name is 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-fluoro-6-piperidin-1-ylpyrimidin-2-amine
PubChem CID676639
Molecular FormulaC9H13FN4
Molecular Weight196.23 g/mol
Exact Mass196.11
IUPAC Name4-fluoro-6-piperidin-1-ylpyrimidin-2-amine
SMILESNc1nc(F)cc(N2CCCCC2)n1
InChIInChI=1S/C9H13FN4/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,12,13)
InChIKeyJHOMLXZSDLLBFN-UHFFFAOYSA-N
XLogP1.19
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N4-methyl-6-piperidin-1-yl-pyrimidine-2,4-diamine
CID 17773877
2,4-Diamino-6-piperidinopyrimidine
CID 606255
6-(4-Methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 753256
N4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 25129179
n4-Cyclopentyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 24797598
4-(4-Methylpiperazin-1-yl)-6-piperidin-1-ylpyrimidin-2-ylamine
CID 24798595
4-N,4-N-diethyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 25129180
4-(4-Methylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidin-2-ylamine
CID 25130912
N2-cyclopentyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 53233802
2-(2-Piperidin-1-yl-ethylsulfanyl)-pyrimidine-4,6-diamine
CID 649133
4-(Piperazin-1-yl)-6-(pyrrolidin-1-yl)pyrimidin-2-amine
CID 54580746
N2-isopropyl-N2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 54581939

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine?
The IUPAC name of 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine (CID 676639) is 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine.
What is the SMILES notation for 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine?
The canonical SMILES for 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine is Nc1nc(F)cc(N2CCCCC2)n1.
What is the InChIKey of 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine?
The InChIKey is JHOMLXZSDLLBFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN4/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,12,13).
What are the key properties of 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine?
4-fluoro-6-piperidin-1-ylpyrimidin-2-amine has a molecular weight of 196.23 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-piperidin-1-ylpyrimidin-2-amine is sourced from PubChem (CID 676639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).