2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C11H14N2O — CID 154016990

IUPAC2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESc1nc(OC2CCC2)nc2c1CCC2
InChIInChI=1S/C11H14N2O/c1-3-8-7-12-11(13-10(8)6-1)14-9-4-2-5-9/h7,9H,1-6H2
InChIKeyVCERLMCCEZYLHD-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.90
Rot. Bonds2

About 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine

2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 154016990) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID154016990
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESc1nc(OC2CCC2)nc2c1CCC2
InChIInChI=1S/C11H14N2O/c1-3-8-7-12-11(13-10(8)6-1)14-9-4-2-5-9/h7,9H,1-6H2
InChIKeyVCERLMCCEZYLHD-UHFFFAOYSA-N
XLogP1.90
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 154016990) is 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine is c1nc(OC2CCC2)nc2c1CCC2.
What is the InChIKey of 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is VCERLMCCEZYLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-3-8-7-12-11(13-10(8)6-1)14-9-4-2-5-9/h7,9H,1-6H2.
What are the key properties of 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 190.25 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 154016990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).