3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine

C18H21N3O — CID 165380558

IUPAC3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine
SMILESCOc1nc(-c2cccc(C(C)C)c2)ccc1C1=NCCN1
InChIInChI=1S/C18H21N3O/c1-12(2)13-5-4-6-14(11-13)16-8-7-15(18(21-16)22-3)17-19-9-10-20-17/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)
InChIKeyDZSQXHZFGWTOIA-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.23
Rot. Bonds4

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

3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine (PubChem CID 165380558) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine.

Molecular Properties

Compound Name3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine
PubChem CID165380558
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine
SMILESCOc1nc(-c2cccc(C(C)C)c2)ccc1C1=NCCN1
InChIInChI=1S/C18H21N3O/c1-12(2)13-5-4-6-14(11-13)16-8-7-15(18(21-16)22-3)17-19-9-10-20-17/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)
InChIKeyDZSQXHZFGWTOIA-UHFFFAOYSA-N
XLogP3.23
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.23
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-(3-propan-2-ylphenyl)pyridine?
The IUPAC name of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine (CID 165380558) is 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine.
What is the SMILES notation for 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine?
The canonical SMILES for 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine is COc1nc(-c2cccc(C(C)C)c2)ccc1C1=NCCN1.
What is the InChIKey of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine?
The InChIKey is DZSQXHZFGWTOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-12(2)13-5-4-6-14(11-13)16-8-7-15(18(21-16)22-3)17-19-9-10-20-17/h4-8,11-12H,9-10H2,1-3H3,(H,19,20).
What are the key properties of 3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine?
3-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-6-(3-propan-2-ylphenyl)pyridine has a molecular weight of 295.39 g/mol, XLogP of 3.23, 4 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-(3-propan-2-ylphenyl)pyridine is sourced from PubChem (CID 165380558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).