2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole

C12H16N2O2 — CID 82242139

IUPAC2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole
SMILESCOCCOc1ccc(C2=NCCN2)cc1
InChIInChI=1S/C12H16N2O2/c1-15-8-9-16-11-4-2-10(3-5-11)12-13-6-7-14-12/h2-5H,6-9H2,1H3,(H,13,14)
InChIKeyVEEXGENUJAKXHP-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.06
Rot. Bonds5

About 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole

2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 82242139) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole
PubChem CID82242139
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole
SMILESCOCCOc1ccc(C2=NCCN2)cc1
InChIInChI=1S/C12H16N2O2/c1-15-8-9-16-11-4-2-10(3-5-11)12-13-6-7-14-12/h2-5H,6-9H2,1H3,(H,13,14)
InChIKeyVEEXGENUJAKXHP-UHFFFAOYSA-N
XLogP1.06
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-pentoxyphenyl)-4,5-dihydro-1H-imidazole
CID 110540504
2-[4-[5-[4-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)phenoxy]pentoxy]phenyl]-4,5,6,7-tetrahydro-1H-1,3-diazepine
CID 127041641
2,6-bis[[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]methyl]pyridine;dihydrochloride
CID 70695580
2-[4-[(4-bromophenoxy)methyl]phenyl]-4,5-dihydro-1H-imidazole
CID 82240381
2-[4-[3-[4-[5-(4,5-dihydro-1H-imidazol-2-yl)-1-benzofuran-2-yl]phenoxy]propoxy]phenyl]-4,5-dihydro-1H-imidazole
CID 11306162
2-[4-(2-phenylethoxy)phenyl]-1,4,5,6-tetrahydropyrimidine
CID 82249038
3-[[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]methyl]pyridine
CID 82245169
2-[4-[6-[4-(1-benzofuran-2-yl)phenoxy]hexoxy]phenyl]-4,5-dihydro-1H-imidazole
CID 141119932
N-(4-chlorophenyl)-2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]acetamide
CID 127037567
2-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxyphenoxy]propoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole;dihydrochloride
CID 90664413
2-[3-(2-methoxyethoxy)-7-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]-4,5-dihydro-1H-imidazole;hydrochloride
CID 57447579
1-(2-methoxyethoxy)-4-phenylbenzene
CID 20582782

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole (CID 82242139) is 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole is COCCOc1ccc(C2=NCCN2)cc1.
What is the InChIKey of 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is VEEXGENUJAKXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-15-8-9-16-11-4-2-10(3-5-11)12-13-6-7-14-12/h2-5H,6-9H2,1H3,(H,13,14).
What are the key properties of 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole?
2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 220.27 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyethoxy)phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 82242139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).