6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine

C12H10N2O2 — CID 123327955

IUPAC6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine
SMILESCOc1ccc(C)c2c1oc1cncnc12
InChIInChI=1S/C12H10N2O2/c1-7-3-4-8(15-2)12-10(7)11-9(16-12)5-13-6-14-11/h3-6H,1-2H3
InChIKeyCKGUIFWJOKNKNN-UHFFFAOYSA-N
MW214.22 g/mol
LogP2.69
Rot. Bonds1

About 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine

6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine (PubChem CID 123327955) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine.

Molecular Properties

Compound Name6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine
PubChem CID123327955
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine
SMILESCOc1ccc(C)c2c1oc1cncnc12
InChIInChI=1S/C12H10N2O2/c1-7-3-4-8(15-2)12-10(7)11-9(16-12)5-13-6-14-11/h3-6H,1-2H3
InChIKeyCKGUIFWJOKNKNN-UHFFFAOYSA-N
XLogP2.69
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-methoxy-4,5-dimethylquinazoline
CID 142290998
4-bromo-3-chloro-8-methoxy-5-methylquinoline
CID 114763949
4-chloro-3-iodo-8-methoxy-5-methylquinoline
CID 102614076
4-(8-methoxy-[1]benzofuro[2,3-c]pyridin-5-yl)pyrrolidin-2-one
CID 67451255
8-methoxy-5-methyl-4-(trifluoromethyl)quinoline-3-carboxylic acid
CID 16779833
5,8-dimethoxyquinazolin-6-amine
CID 605485
5-methoxy-2,3,8-trimethylquinoxaline
CID 121009492
5-methoxy-8-methylquinolin-3-ol
CID 130496401
8-chloro-[1]benzofuro[3,2-d]pyrimidine
CID 141392235
8-methoxy-2,5-dimethylquinolin-4-amine
CID 62202032
5-methoxy-39-oxadecacyclo[12.12.12.16,9.01,14.02,7.08,13.015,20.021,26.027,32.033,38]nonatriaconta-2(7),3,5,8(13),9,11,15,17,19,21,23,25,27,29,31,33,35,37-octadecaene
CID 153308817
8-methoxy-6-propan-2-ylquinazoline
CID 159245252

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine?
The IUPAC name of 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine (CID 123327955) is 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine.
What is the SMILES notation for 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine?
The canonical SMILES for 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine is COc1ccc(C)c2c1oc1cncnc12.
What is the InChIKey of 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine?
The InChIKey is CKGUIFWJOKNKNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c1-7-3-4-8(15-2)12-10(7)11-9(16-12)5-13-6-14-11/h3-6H,1-2H3.
What are the key properties of 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine?
6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine has a molecular weight of 214.22 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-9-methyl-[1]benzofuro[3,2-d]pyrimidine is sourced from PubChem (CID 123327955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).