5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine

C10H14FN3 — CID 139490684

IUPAC5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine
SMILESFc1cnc(C[C@H]2CCCNC2)nc1
InChIInChI=1S/C10H14FN3/c11-9-6-13-10(14-7-9)4-8-2-1-3-12-5-8/h6-8,12H,1-5H2/t8-/m1/s1
InChIKeyASLHCINOXSOXHM-MRVPVSSYSA-N
MW195.24 g/mol
LogP1.16
Rot. Bonds2

About 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine

5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine (PubChem CID 139490684) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine.

Molecular Properties

Compound Name5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine
PubChem CID139490684
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC Name5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine
SMILESFc1cnc(C[C@H]2CCCNC2)nc1
InChIInChI=1S/C10H14FN3/c11-9-6-13-10(14-7-9)4-8-2-1-3-12-5-8/h6-8,12H,1-5H2/t8-/m1/s1
InChIKeyASLHCINOXSOXHM-MRVPVSSYSA-N
XLogP1.16
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclohexyl-5-fluoropyrimidin-4-amine
CID 3573094
1-Cyclohexyl-4-[4-(5-fluoro-pyrimidin-2-yl)-piperazin-1-yl]-butylamine
CID 15729927
5-Fluoro-2-(piperidin-1-yl)pyrimidin-4-amine
CID 745185
1-(2-Pyrimidinyl)-4-piperidinemethanamine
CID 10631607
N-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]pyrimidin-2-amine
CID 71978664
[1-(Pyrimidin-2-yl)piperidin-3-yl]methanamine
CID 44721316
2-(Piperidin-4-yl)pyrimidin-4-amine
CID 45788839
5-Chloro-2-(piperidin-4-YL)pyrimidine
CID 55262357
2-(Piperidin-3-yl)pyrimidine dihydrochloride
CID 126809416
2-(Piperidin-4-yl)pyrimidine dihydrochloride
CID 132300833
5-Bromo-2-(piperidin-3-yl)pyrimidine dihydrochloride
CID 132300864
2-(Piperidin-4-yl)pyrimidine-5-carbonitrile dihydrochloride
CID 155821054

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine?
The IUPAC name of 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine (CID 139490684) is 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine.
What is the SMILES notation for 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine?
The canonical SMILES for 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine is Fc1cnc(C[C@H]2CCCNC2)nc1.
What is the InChIKey of 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine?
The InChIKey is ASLHCINOXSOXHM-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14FN3/c11-9-6-13-10(14-7-9)4-8-2-1-3-12-5-8/h6-8,12H,1-5H2/t8-/m1/s1.
What are the key properties of 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine?
5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine has a molecular weight of 195.24 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[[(3R)-piperidin-3-yl]methyl]pyrimidine is sourced from PubChem (CID 139490684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).