1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone

C15H24N4O — CID 114707098

IUPAC1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone
SMILESO=C(Cn1cncc1C1CCCCN1)N1CCCCC1
InChIInChI=1S/C15H24N4O/c20-15(18-8-4-1-5-9-18)11-19-12-16-10-14(19)13-6-2-3-7-17-13/h10,12-13,17H,1-9,11H2
InChIKeyWUDAKWIJXYLOCZ-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.71
Rot. Bonds3

About 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone

1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone (PubChem CID 114707098) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone.

Molecular Properties

Compound Name1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone
PubChem CID114707098
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone
SMILESO=C(Cn1cncc1C1CCCCN1)N1CCCCC1
InChIInChI=1S/C15H24N4O/c20-15(18-8-4-1-5-9-18)11-19-12-16-10-14(19)13-6-2-3-7-17-13/h10,12-13,17H,1-9,11H2
InChIKeyWUDAKWIJXYLOCZ-UHFFFAOYSA-N
XLogP1.71
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-piperidin-4-ylimidazol-1-yl)-1-pyrrolidin-1-ylethanone
CID 114707092
ethyl 2-(5-piperidin-2-ylimidazol-1-yl)acetate
CID 114704303
2-[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]acetamide
CID 104942020
1-piperidin-1-yl-2-(5-pyrrolidin-2-ylimidazol-1-yl)propan-1-one
CID 114707108
ethyl 4-(5-piperidin-2-ylimidazol-1-yl)butanoate
CID 114706340
N,2,2-trimethyl-3-(5-piperidin-2-ylimidazol-1-yl)propanamide
CID 106278204
1-ethyl-5-pyrrolidin-2-ylimidazole
CID 66134082
2-[3-(4,4,4-trifluorobutyl)imidazol-4-yl]piperidine
CID 114707003
1-piperidin-1-yl-3-(5-piperidin-4-ylimidazol-1-yl)propan-1-one
CID 114707224
2-[3-(2-methylbutyl)imidazol-4-yl]piperidine
CID 114705654
N-[2-[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]ethyl]acetamide
CID 104942233
2-[3-(4-imidazol-1-ylbutyl)imidazol-4-yl]piperidine
CID 114704857

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone?
The IUPAC name of 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone (CID 114707098) is 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone.
What is the SMILES notation for 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone?
The canonical SMILES for 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone is O=C(Cn1cncc1C1CCCCN1)N1CCCCC1.
What is the InChIKey of 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone?
The InChIKey is WUDAKWIJXYLOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c20-15(18-8-4-1-5-9-18)11-19-12-16-10-14(19)13-6-2-3-7-17-13/h10,12-13,17H,1-9,11H2.
What are the key properties of 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone?
1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone has a molecular weight of 276.38 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone is sourced from PubChem (CID 114707098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).