2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine

C11H9N3O — CID 115403452

IUPAC2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine
SMILESCc1c(-c2ccco2)nc2ncccn12
InChIInChI=1S/C11H9N3O/c1-8-10(9-4-2-7-15-9)13-11-12-5-3-6-14(8)11/h2-7H,1H3
InChIKeyDLQPKVMPNARKRW-UHFFFAOYSA-N
MW199.21 g/mol
LogP2.30
Rot. Bonds1

About 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine

2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine (PubChem CID 115403452) has the molecular formula C11H9N3O and a molecular weight of 199.21 g/mol. Its IUPAC name is 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine
PubChem CID115403452
Molecular FormulaC11H9N3O
Molecular Weight199.21 g/mol
Exact Mass199.07
IUPAC Name2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine
SMILESCc1c(-c2ccco2)nc2ncccn12
InChIInChI=1S/C11H9N3O/c1-8-10(9-4-2-7-15-9)13-11-12-5-3-6-14(8)11/h2-7H,1H3
InChIKeyDLQPKVMPNARKRW-UHFFFAOYSA-N
XLogP2.30
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine (CID 115403452) is 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine is Cc1c(-c2ccco2)nc2ncccn12.
What is the InChIKey of 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine?
The InChIKey is DLQPKVMPNARKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O/c1-8-10(9-4-2-7-15-9)13-11-12-5-3-6-14(8)11/h2-7H,1H3.
What are the key properties of 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine?
2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine has a molecular weight of 199.21 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 115403452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).