5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine

C10H15N3O — CID 66247592

IUPAC5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
SMILESCc1cnc(O[C@H]2CCCNC2)nc1
InChIInChI=1S/C10H15N3O/c1-8-5-12-10(13-6-8)14-9-3-2-4-11-7-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m0/s1
InChIKeyQDIRXQGIMCIUIO-VIFPVBQESA-N
MW193.25 g/mol
LogP0.92
Rot. Bonds2

About 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine

5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine (PubChem CID 66247592) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine.

Molecular Properties

Compound Name5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
PubChem CID66247592
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
SMILESCc1cnc(O[C@H]2CCCNC2)nc1
InChIInChI=1S/C10H15N3O/c1-8-5-12-10(13-6-8)14-9-3-2-4-11-7-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m0/s1
InChIKeyQDIRXQGIMCIUIO-VIFPVBQESA-N
XLogP0.92
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyrimidine
CID 95031425
5-methyl-2-[(3S)-piperidin-3-yl]oxypyridine
CID 66246612
4-chloro-5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
CID 71639114
4,6-dimethyl-2-piperidin-3-yloxypyrimidine;hydrochloride
CID 71638406
5-bromo-4-methoxy-2-[(3S)-piperidin-3-yl]oxypyrimidine
CID 106999610
2-methyl-5-piperidin-3-yloxypyridine
CID 18712955
5-fluoro-2-[(3S)-pyrrolidin-3-yl]oxypyrimidine
CID 71643584
5-piperidin-3-yloxypyrimidin-2-amine
CID 117230818
4-chloro-6-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine;hydrochloride
CID 71638492
3-(3,5-dimethylphenoxy)azepane
CID 82019169
2-[(3R)-piperidin-3-yl]oxypyrazine
CID 71637336
3-(3,4,5-trimethylphenoxy)piperidine
CID 91468136

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine?
The IUPAC name of 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine (CID 66247592) is 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine.
What is the SMILES notation for 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine?
The canonical SMILES for 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine is Cc1cnc(O[C@H]2CCCNC2)nc1.
What is the InChIKey of 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine?
The InChIKey is QDIRXQGIMCIUIO-VIFPVBQESA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-5-12-10(13-6-8)14-9-3-2-4-11-7-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m0/s1.
What are the key properties of 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine?
5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine has a molecular weight of 193.25 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine is sourced from PubChem (CID 66247592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).