1-ethyl-5-pyrrolidin-2-ylimidazole

C9H15N3 — CID 66134082

IUPAC1-ethyl-5-pyrrolidin-2-ylimidazole
SMILESCCn1cncc1C1CCCN1
InChIInChI=1S/C9H15N3/c1-2-12-7-10-6-9(12)8-4-3-5-11-8/h6-8,11H,2-5H2,1H3
InChIKeyHRPRADQYBWEGOT-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.33
Rot. Bonds2

About 1-ethyl-5-pyrrolidin-2-ylimidazole

1-ethyl-5-pyrrolidin-2-ylimidazole (PubChem CID 66134082) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-ethyl-5-pyrrolidin-2-ylimidazole.

Molecular Properties

Compound Name1-ethyl-5-pyrrolidin-2-ylimidazole
PubChem CID66134082
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-ethyl-5-pyrrolidin-2-ylimidazole
SMILESCCn1cncc1C1CCCN1
InChIInChI=1S/C9H15N3/c1-2-12-7-10-6-9(12)8-4-3-5-11-8/h6-8,11H,2-5H2,1H3
InChIKeyHRPRADQYBWEGOT-UHFFFAOYSA-N
XLogP1.33
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dimethylbutyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104943295
1-(2-ethylbutyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104943987
1-(2-ethoxyethyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104941455
1-(3-methyl-2-propan-2-ylbutyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 102909128
5-pyrrolidin-2-yl-1-(2,2,3,3-tetrafluoropropyl)imidazole
CID 106291736
1-(2-ethoxypropyl)-5-pyrrolidin-2-ylimidazole
CID 114707453
1-(2-ethyl-2-methylsulfanylbutyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 114117598
1-(2-methylsulfonylethyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942355
1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole
CID 107421507
2-[3-(2-methylbutyl)imidazol-4-yl]piperidine
CID 114705654
1-(4-methylpentyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104943065
4-[[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]methyl]pyridine
CID 104942141

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-pyrrolidin-2-ylimidazole?
The IUPAC name of 1-ethyl-5-pyrrolidin-2-ylimidazole (CID 66134082) is 1-ethyl-5-pyrrolidin-2-ylimidazole.
What is the SMILES notation for 1-ethyl-5-pyrrolidin-2-ylimidazole?
The canonical SMILES for 1-ethyl-5-pyrrolidin-2-ylimidazole is CCn1cncc1C1CCCN1.
What is the InChIKey of 1-ethyl-5-pyrrolidin-2-ylimidazole?
The InChIKey is HRPRADQYBWEGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-12-7-10-6-9(12)8-4-3-5-11-8/h6-8,11H,2-5H2,1H3.
What are the key properties of 1-ethyl-5-pyrrolidin-2-ylimidazole?
1-ethyl-5-pyrrolidin-2-ylimidazole has a molecular weight of 165.24 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-pyrrolidin-2-ylimidazole is sourced from PubChem (CID 66134082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).