1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine

C15H26N4 — CID 114719115

IUPAC1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine
SMILESCCN1CCC(Cn2cncc2C2CCNC2)CC1
InChIInChI=1S/C15H26N4/c1-2-18-7-4-13(5-8-18)11-19-12-17-10-15(19)14-3-6-16-9-14/h10,12-14,16H,2-9,11H2,1H3
InChIKeyJBGXETQLNNVEPW-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.69
Rot. Bonds4

About 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine

1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine (PubChem CID 114719115) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine.

Molecular Properties

Compound Name1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine
PubChem CID114719115
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine
SMILESCCN1CCC(Cn2cncc2C2CCNC2)CC1
InChIInChI=1S/C15H26N4/c1-2-18-7-4-13(5-8-18)11-19-12-17-10-15(19)14-3-6-16-9-14/h10,12-14,16H,2-9,11H2,1H3
InChIKeyJBGXETQLNNVEPW-UHFFFAOYSA-N
XLogP1.69
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-butyl-5-pyrrolidin-3-ylimidazole
CID 114716363
1-pentyl-5-pyrrolidin-3-ylimidazole
CID 114716240
1-(2-cyclobutylethyl)-5-pyrrolidin-3-ylimidazole
CID 114722227
1-(2-methyl-3-pyrrolidin-1-ylpropyl)-5-pyrrolidin-3-ylimidazole
CID 114720180
1-(3-methylbut-2-enyl)-5-pyrrolidin-3-ylimidazole
CID 106194342
1-(2-ethyl-2-methylsulfanylbutyl)-5-pyrrolidin-3-ylimidazole
CID 114117594
N,N-dimethyl-3-(5-pyrrolidin-3-ylimidazol-1-yl)propanamide
CID 114718789
3-(3-butylimidazol-4-yl)piperidine
CID 114702793
1-(3-methylsulfonylpropyl)-5-pyrrolidin-3-ylimidazole
CID 114718583
1-methyl-2-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]imidazole
CID 114720604
5-ethyl-2-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]-1,3-oxazole
CID 114180990
1-(2-phenylethyl)-5-pyrrolidin-3-ylimidazole
CID 114716968

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine?
The IUPAC name of 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine (CID 114719115) is 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine.
What is the SMILES notation for 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine?
The canonical SMILES for 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine is CCN1CCC(Cn2cncc2C2CCNC2)CC1.
What is the InChIKey of 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine?
The InChIKey is JBGXETQLNNVEPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-2-18-7-4-13(5-8-18)11-19-12-17-10-15(19)14-3-6-16-9-14/h10,12-14,16H,2-9,11H2,1H3.
What are the key properties of 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine?
1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine has a molecular weight of 262.40 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[(5-pyrrolidin-3-ylimidazol-1-yl)methyl]piperidine is sourced from PubChem (CID 114719115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).