2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine

C19H23N3O — CID 59912621

IUPAC2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine
SMILESCOc1cccc(C(c2ccccn2)C(C)CC2=NCCN2)c1
InChIInChI=1S/C19H23N3O/c1-14(12-18-21-10-11-22-18)19(17-8-3-4-9-20-17)15-6-5-7-16(13-15)23-2/h3-9,13-14,19H,10-12H2,1-2H3,(H,21,22)
InChIKeyRRBUIUDSMWCODZ-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.25
Rot. Bonds6

About 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine

2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine (PubChem CID 59912621) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine.

Molecular Properties

Compound Name2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine
PubChem CID59912621
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine
SMILESCOc1cccc(C(c2ccccn2)C(C)CC2=NCCN2)c1
InChIInChI=1S/C19H23N3O/c1-14(12-18-21-10-11-22-18)19(17-8-3-4-9-20-17)15-6-5-7-16(13-15)23-2/h3-9,13-14,19H,10-12H2,1-2H3,(H,21,22)
InChIKeyRRBUIUDSMWCODZ-UHFFFAOYSA-N
XLogP3.25
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)ethyl]isoquinoline
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4,5-dihydro-1H-imidazole;2-[2-(4,5-dihydro-1H-imidazol-2-yl)-1-phenylethyl]pyridine
CID 69188313
3-(4,5-dihydro-1H-imidazol-2-yl)-1,1-diphenylpropane-2-thiol
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2-[(3-methoxyphenyl)-naphthalen-2-ylsulfanylmethyl]pyridine
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hydron;2-[(2-propan-2-ylphenoxy)methyl]-4,5-dihydro-1H-imidazole;chloride
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1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine?
The IUPAC name of 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine (CID 59912621) is 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine.
What is the SMILES notation for 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine?
The canonical SMILES for 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine is COc1cccc(C(c2ccccn2)C(C)CC2=NCCN2)c1.
What is the InChIKey of 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine?
The InChIKey is RRBUIUDSMWCODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-14(12-18-21-10-11-22-18)19(17-8-3-4-9-20-17)15-6-5-7-16(13-15)23-2/h3-9,13-14,19H,10-12H2,1-2H3,(H,21,22).
What are the key properties of 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine?
2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine has a molecular weight of 309.41 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4,5-dihydro-1H-imidazol-2-yl)-1-(3-methoxyphenyl)-2-methylpropyl]pyridine is sourced from PubChem (CID 59912621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).