5-[fluoro(piperidin-4-yl)methyl]pyrimidine

C10H14FN3 — CID 112563760

IUPAC5-[fluoro(piperidin-4-yl)methyl]pyrimidine
SMILESFC(c1cncnc1)C1CCNCC1
InChIInChI=1S/C10H14FN3/c11-10(8-1-3-12-4-2-8)9-5-13-7-14-6-9/h5-8,10,12H,1-4H2
InChIKeyQYUPLWAMYFARHH-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.49
Rot. Bonds2

About 5-[fluoro(piperidin-4-yl)methyl]pyrimidine

5-[fluoro(piperidin-4-yl)methyl]pyrimidine (PubChem CID 112563760) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is 5-[fluoro(piperidin-4-yl)methyl]pyrimidine.

Molecular Properties

Compound Name5-[fluoro(piperidin-4-yl)methyl]pyrimidine
PubChem CID112563760
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC Name5-[fluoro(piperidin-4-yl)methyl]pyrimidine
SMILESFC(c1cncnc1)C1CCNCC1
InChIInChI=1S/C10H14FN3/c11-10(8-1-3-12-4-2-8)9-5-13-7-14-6-9/h5-8,10,12H,1-4H2
InChIKeyQYUPLWAMYFARHH-UHFFFAOYSA-N
XLogP1.49
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 ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[fluoro(piperidin-4-yl)methyl]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(4-bromophenyl)-fluoromethyl]piperidine
CID 84730148
4-[(3,4-dichlorophenyl)-fluoromethyl]piperidine
CID 112563633
4-[fluoro(phenyl)methyl]azepane
CID 84722518
4-[(4-chloro-1-methylpyrazol-5-yl)-fluoromethyl]piperidine
CID 114667700
(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine
CID 171314087
4-[2,3-dihydro-1-benzofuran-5-yl(fluoro)methyl]piperidine
CID 104545402
4-[fluoro-(3-propylphenyl)methyl]piperidine
CID 116546553
4-[(4-chloro-1-propan-2-ylpyrazol-5-yl)-fluoromethyl]piperidine
CID 114667704
2-pyrimidin-5-yl-3-pyrrolidin-3-ylpropanoic acid
CID 129285768
4-[(2,4-dimethylphenyl)-fluoromethyl]piperidine
CID 112563629
4-[1-(1H-pyrazol-4-yl)ethyl]piperidine
CID 84657149
5-pyrrolidin-3-ylpyrimidine
CID 66996535

Frequently Asked Questions

What is the IUPAC name of 5-[fluoro(piperidin-4-yl)methyl]pyrimidine?
The IUPAC name of 5-[fluoro(piperidin-4-yl)methyl]pyrimidine (CID 112563760) is 5-[fluoro(piperidin-4-yl)methyl]pyrimidine.
What is the SMILES notation for 5-[fluoro(piperidin-4-yl)methyl]pyrimidine?
The canonical SMILES for 5-[fluoro(piperidin-4-yl)methyl]pyrimidine is FC(c1cncnc1)C1CCNCC1.
What is the InChIKey of 5-[fluoro(piperidin-4-yl)methyl]pyrimidine?
The InChIKey is QYUPLWAMYFARHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3/c11-10(8-1-3-12-4-2-8)9-5-13-7-14-6-9/h5-8,10,12H,1-4H2.
What are the key properties of 5-[fluoro(piperidin-4-yl)methyl]pyrimidine?
5-[fluoro(piperidin-4-yl)methyl]pyrimidine has a molecular weight of 195.24 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[fluoro(piperidin-4-yl)methyl]pyrimidine is sourced from PubChem (CID 112563760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).