6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine

C10H11N3O — CID 164559107

IUPAC6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine
SMILESCOc1cnc2cnc(C3CC3)n2c1
InChIInChI=1S/C10H11N3O/c1-14-8-4-11-9-5-12-10(7-2-3-7)13(9)6-8/h4-7H,2-3H2,1H3
InChIKeyBHDQYERTSQHOSY-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.62
Rot. Bonds2

About 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine

6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine (PubChem CID 164559107) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine
PubChem CID164559107
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine
SMILESCOc1cnc2cnc(C3CC3)n2c1
InChIInChI=1S/C10H11N3O/c1-14-8-4-11-9-5-12-10(7-2-3-7)13(9)6-8/h4-7H,2-3H2,1H3
InChIKeyBHDQYERTSQHOSY-UHFFFAOYSA-N
XLogP1.62
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine?
The IUPAC name of 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine (CID 164559107) is 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine.
What is the SMILES notation for 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine?
The canonical SMILES for 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine is COc1cnc2cnc(C3CC3)n2c1.
What is the InChIKey of 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine?
The InChIKey is BHDQYERTSQHOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-14-8-4-11-9-5-12-10(7-2-3-7)13(9)6-8/h4-7H,2-3H2,1H3.
What are the key properties of 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine?
6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine has a molecular weight of 189.22 g/mol, XLogP of 1.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-methoxyimidazo[1,5-a]pyrimidine is sourced from PubChem (CID 164559107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).