4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C13H19N3O — CID 105493352

IUPAC4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESCOc1nc(C2CCCNC2)nc2c1CCC2
InChIInChI=1S/C13H19N3O/c1-17-13-10-5-2-6-11(10)15-12(16-13)9-4-3-7-14-8-9/h9,14H,2-8H2,1H3
InChIKeyCQXAAVGBBVVLJM-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.44
Rot. Bonds2

About 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine

4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 105493352) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID105493352
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESCOc1nc(C2CCCNC2)nc2c1CCC2
InChIInChI=1S/C13H19N3O/c1-17-13-10-5-2-6-11(10)15-12(16-13)9-4-3-7-14-8-9/h9,14H,2-8H2,1H3
InChIKeyCQXAAVGBBVVLJM-UHFFFAOYSA-N
XLogP1.44
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-2-piperidin-3-yl-5,7-dihydrofuro[3,4-d]pyrimidine
CID 105496379
4-methoxy-2-pyrrolidin-3-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 115040229
4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine
CID 105499490
4-methyl-2-piperidin-3-yl-5,7-dihydrofuro[3,4-d]pyrimidine
CID 105474388
4-methoxy-2-piperidin-4-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 115040233
4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
4,6-dimethyl-2-piperidin-3-ylpyrimidine;dihydrochloride
CID 71299007
2-methoxy-3-methyl-5-piperidin-3-ylpyrazine
CID 83833851
3-methoxy-6-piperidin-3-ylpyridazin-4-amine
CID 117105660
2-piperidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 105498181
2,4-dimethoxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 156555750
2-[(3R)-piperidin-3-yl]pyrimidine
CID 86328129

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 105493352) is 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine is COc1nc(C2CCCNC2)nc2c1CCC2.
What is the InChIKey of 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is CQXAAVGBBVVLJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-17-13-10-5-2-6-11(10)15-12(16-13)9-4-3-7-14-8-9/h9,14H,2-8H2,1H3.
What are the key properties of 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 233.31 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 105493352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).