2-[(3R)-piperidin-3-yl]pyrimidine

C9H13N3 — CID 86328129

IUPAC2-[(3R)-piperidin-3-yl]pyrimidine
SMILESc1cnc([C@@H]2CCCNC2)nc1
InChIInChI=1S/C9H13N3/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h2,5-6,8,10H,1,3-4,7H2/t8-/m1/s1
InChIKeyZUQHRLRCFROOPV-MRVPVSSYSA-N
MW163.22 g/mol
LogP0.94
Rot. Bonds1

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

2-[(3R)-piperidin-3-yl]pyrimidine (PubChem CID 86328129) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-[(3R)-piperidin-3-yl]pyrimidine.

Molecular Properties

Compound Name2-[(3R)-piperidin-3-yl]pyrimidine
PubChem CID86328129
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name2-[(3R)-piperidin-3-yl]pyrimidine
SMILESc1cnc([C@@H]2CCCNC2)nc1
InChIInChI=1S/C9H13N3/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h2,5-6,8,10H,1,3-4,7H2/t8-/m1/s1
InChIKeyZUQHRLRCFROOPV-MRVPVSSYSA-N
XLogP0.94
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-piperidin-3-ylpyrimidin-5-ol
CID 117231651
2-cyclobutylpyrimidine
CID 18329571
6-methyl-2-[(3S)-piperidin-3-yl]-N-pyrimidin-2-ylpyrimidin-4-amine
CID 125027098
3-piperidin-3-yl-1,2,4-oxadiazole;hydrochloride
CID 75531100
3-piperidin-3-yl-N-pyrimidin-2-ylpyrazin-2-amine
CID 175661062
3-piperidin-3-yl-5-pyridin-2-yl-1,2,4-oxadiazole;dihydrochloride
CID 68962118
3-(1H-imidazol-2-yl)piperidine
CID 13281195
4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
3-piperidin-3-ylpyridine-2-carbaldehyde
CID 175124211
4-piperidin-3-ylpyridine;dihydrochloride
CID 91809614
4,6-dimethyl-2-piperidin-3-ylpyrimidine;dihydrochloride
CID 71299007
4-[(3S)-piperidin-3-yl]-N-pyrimidin-2-ylpyrimidin-2-amine
CID 125011656

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-piperidin-3-yl]pyrimidine?
The IUPAC name of 2-[(3R)-piperidin-3-yl]pyrimidine (CID 86328129) is 2-[(3R)-piperidin-3-yl]pyrimidine.
What is the SMILES notation for 2-[(3R)-piperidin-3-yl]pyrimidine?
The canonical SMILES for 2-[(3R)-piperidin-3-yl]pyrimidine is c1cnc([C@@H]2CCCNC2)nc1.
What is the InChIKey of 2-[(3R)-piperidin-3-yl]pyrimidine?
The InChIKey is ZUQHRLRCFROOPV-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H13N3/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h2,5-6,8,10H,1,3-4,7H2/t8-/m1/s1.
What are the key properties of 2-[(3R)-piperidin-3-yl]pyrimidine?
2-[(3R)-piperidin-3-yl]pyrimidine has a molecular weight of 163.22 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-piperidin-3-yl]pyrimidine is sourced from PubChem (CID 86328129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).