1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole

C14H14N2O2 — CID 23311216

IUPAC1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole
SMILESCOc1ccc2c(c1)C=C(n1ccnc1)C(C)O2
InChIInChI=1S/C14H14N2O2/c1-10-13(16-6-5-15-9-16)8-11-7-12(17-2)3-4-14(11)18-10/h3-10H,1-2H3
InChIKeyZPEJLBFXQCBDGK-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.67
Rot. Bonds2

About 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole

1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole (PubChem CID 23311216) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole.

Molecular Properties

Compound Name1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole
PubChem CID23311216
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole
SMILESCOc1ccc2c(c1)C=C(n1ccnc1)C(C)O2
InChIInChI=1S/C14H14N2O2/c1-10-13(16-6-5-15-9-16)8-11-7-12(17-2)3-4-14(11)18-10/h3-10H,1-2H3
InChIKeyZPEJLBFXQCBDGK-UHFFFAOYSA-N
XLogP2.67
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole?
The IUPAC name of 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole (CID 23311216) is 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole.
What is the SMILES notation for 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole?
The canonical SMILES for 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole is COc1ccc2c(c1)C=C(n1ccnc1)C(C)O2.
What is the InChIKey of 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole?
The InChIKey is ZPEJLBFXQCBDGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-10-13(16-6-5-15-9-16)8-11-7-12(17-2)3-4-14(11)18-10/h3-10H,1-2H3.
What are the key properties of 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole?
1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole has a molecular weight of 242.28 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-2-methyl-2H-chromen-3-yl)imidazole is sourced from PubChem (CID 23311216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).