3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine

C15H26N4 — CID 114705204

IUPAC3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine
SMILESCC(CN1CCCC1)n1cncc1C1CCCNC1
InChIInChI=1S/C15H26N4/c1-13(11-18-7-2-3-8-18)19-12-17-10-15(19)14-5-4-6-16-9-14/h10,12-14,16H,2-9,11H2,1H3
InChIKeyAPHOVCLOEJUMSJ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.01
Rot. Bonds4

About 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine

3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine (PubChem CID 114705204) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine.

Molecular Properties

Compound Name3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine
PubChem CID114705204
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine
SMILESCC(CN1CCCC1)n1cncc1C1CCCNC1
InChIInChI=1S/C15H26N4/c1-13(11-18-7-2-3-8-18)19-12-17-10-15(19)14-5-4-6-16-9-14/h10,12-14,16H,2-9,11H2,1H3
InChIKeyAPHOVCLOEJUMSJ-UHFFFAOYSA-N
XLogP2.01
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 ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methyl-3-pyrrolidin-1-ylpropyl)-5-pyrrolidin-3-ylimidazole
CID 114720180
3-(3-octan-2-ylimidazol-4-yl)piperidine
CID 114704680
N,N-dimethyl-1-(5-piperidin-3-ylimidazol-1-yl)propan-2-amine
CID 114704884
3-[3-(3-methyl-2-propan-2-ylbutyl)imidazol-4-yl]piperidine
CID 102909112
2-(5-piperidin-3-ylimidazol-1-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 114707049
1-piperidin-1-yl-2-(5-piperidin-3-ylimidazol-1-yl)propan-1-one
CID 114707115
1-[2-(5-piperidin-3-ylimidazol-1-yl)ethyl]piperidine
CID 114704706
1-(1-methoxypropan-2-yl)-5-pyrrolidin-3-ylimidazole
CID 114716573
3-[3-(2,2-dicyclopropylethyl)imidazol-4-yl]piperidine
CID 114706511
2-methyl-6-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine
CID 114719364
3-[3-[1-(furan-2-yl)ethyl]imidazol-4-yl]piperidine
CID 114704110
3-[3-[1-(2,5-dimethylfuran-3-yl)ethyl]imidazol-4-yl]piperidine
CID 114705230

Frequently Asked Questions

What is the IUPAC name of 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine?
The IUPAC name of 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine (CID 114705204) is 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine.
What is the SMILES notation for 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine?
The canonical SMILES for 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine is CC(CN1CCCC1)n1cncc1C1CCCNC1.
What is the InChIKey of 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine?
The InChIKey is APHOVCLOEJUMSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-13(11-18-7-2-3-8-18)19-12-17-10-15(19)14-5-4-6-16-9-14/h10,12-14,16H,2-9,11H2,1H3.
What are the key properties of 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine?
3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine has a molecular weight of 262.40 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine is sourced from PubChem (CID 114705204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).