3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine

C15H15N3O — CID 166071235

IUPAC3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine
SMILESCOc1nc(-c2ccccc2)ccc1C1=NCCN1
InChIInChI=1S/C15H15N3O/c1-19-15-12(14-16-9-10-17-14)7-8-13(18-15)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,17)
InChIKeyNCTAJROHGPEDGY-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.11
Rot. Bonds3

About 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine

3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine (PubChem CID 166071235) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine.

Molecular Properties

Compound Name3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine
PubChem CID166071235
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine
SMILESCOc1nc(-c2ccccc2)ccc1C1=NCCN1
InChIInChI=1S/C15H15N3O/c1-19-15-12(14-16-9-10-17-14)7-8-13(18-15)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,17)
InChIKeyNCTAJROHGPEDGY-UHFFFAOYSA-N
XLogP2.11
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine?
The IUPAC name of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine (CID 166071235) is 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine.
What is the SMILES notation for 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine?
The canonical SMILES for 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine is COc1nc(-c2ccccc2)ccc1C1=NCCN1.
What is the InChIKey of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine?
The InChIKey is NCTAJROHGPEDGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-19-15-12(14-16-9-10-17-14)7-8-13(18-15)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,17).
What are the key properties of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine?
3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine has a molecular weight of 253.31 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-phenylpyridine is sourced from PubChem (CID 166071235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).