6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

C13H14N2O — CID 44574938

IUPAC6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
SMILESCOc1cccc(C2Cc3nccn3C2)c1
InChIInChI=1S/C13H14N2O/c1-16-12-4-2-3-10(7-12)11-8-13-14-5-6-15(13)9-11/h2-7,11H,8-9H2,1H3
InChIKeyOZJCKBRXCUUNCT-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.23
Rot. Bonds2

About 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole (PubChem CID 44574938) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole.

Molecular Properties

Compound Name6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
PubChem CID44574938
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
SMILESCOc1cccc(C2Cc3nccn3C2)c1
InChIInChI=1S/C13H14N2O/c1-16-12-4-2-3-10(7-12)11-8-13-14-5-6-15(13)9-11/h2-7,11H,8-9H2,1H3
InChIKeyOZJCKBRXCUUNCT-UHFFFAOYSA-N
XLogP2.23
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-Methoxy-3,4-dihydronaphthalen-2-yl)-1H-imidazole
CID 3021561
1-[5-(4-Ethylphenoxy)pentyl]imidazole
CID 2852313
1-[3-(3-methylphenoxy)propyl]-1H-imidazole
CID 2841257
1-[5-(3-Methylphenoxy)pentyl]imidazole
CID 3787293
1-[5-(2-Methylphenoxy)pentyl]imidazole
CID 3841658
1-[5-(2,5-Dimethylphenoxy)pentyl]imidazole
CID 4993461
2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole hydrobromide
CID 6603264
rac-1-[1-(3''-Methoxy-biphenyl-4-yl)-propyl]-1H-imidazole
CID 42643327
2-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-1H-imidazole
CID 44449277
6-(2-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 44574937
6-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 44574985
6-(2-(difluoromethoxy)phenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 44574987

Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The IUPAC name of 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole (CID 44574938) is 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole.
What is the SMILES notation for 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The canonical SMILES for 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole is COc1cccc(C2Cc3nccn3C2)c1.
What is the InChIKey of 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The InChIKey is OZJCKBRXCUUNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-16-12-4-2-3-10(7-12)11-8-13-14-5-6-15(13)9-11/h2-7,11H,8-9H2,1H3.
What are the key properties of 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole has a molecular weight of 214.27 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole is sourced from PubChem (CID 44574938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).