4-(3-imidazol-1-ylpropyl)piperidine

C11H19N3 — CID 13281196

IUPAC4-(3-imidazol-1-ylpropyl)piperidine
SMILESc1cn(CCCC2CCNCC2)cn1
InChIInChI=1S/C11H19N3/c1(8-14-9-7-13-10-14)2-11-3-5-12-6-4-11/h7,9-12H,1-6,8H2
InChIKeyYVGKIZVFJBMQCH-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.66
Rot. Bonds4

About 4-(3-imidazol-1-ylpropyl)piperidine

4-(3-imidazol-1-ylpropyl)piperidine (PubChem CID 13281196) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-(3-imidazol-1-ylpropyl)piperidine.

Molecular Properties

Compound Name4-(3-imidazol-1-ylpropyl)piperidine
PubChem CID13281196
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4-(3-imidazol-1-ylpropyl)piperidine
SMILESc1cn(CCCC2CCNCC2)cn1
InChIInChI=1S/C11H19N3/c1(8-14-9-7-13-10-14)2-11-3-5-12-6-4-11/h7,9-12H,1-6,8H2
InChIKeyYVGKIZVFJBMQCH-UHFFFAOYSA-N
XLogP1.66
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-imidazol-1-ylpropyl)piperidine?
The IUPAC name of 4-(3-imidazol-1-ylpropyl)piperidine (CID 13281196) is 4-(3-imidazol-1-ylpropyl)piperidine.
What is the SMILES notation for 4-(3-imidazol-1-ylpropyl)piperidine?
The canonical SMILES for 4-(3-imidazol-1-ylpropyl)piperidine is c1cn(CCCC2CCNCC2)cn1.
What is the InChIKey of 4-(3-imidazol-1-ylpropyl)piperidine?
The InChIKey is YVGKIZVFJBMQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1(8-14-9-7-13-10-14)2-11-3-5-12-6-4-11/h7,9-12H,1-6,8H2.
What are the key properties of 4-(3-imidazol-1-ylpropyl)piperidine?
4-(3-imidazol-1-ylpropyl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-imidazol-1-ylpropyl)piperidine is sourced from PubChem (CID 13281196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).