4-(1,5-dimethylimidazol-4-yl)piperidine

C10H17N3 — CID 84657143

IUPAC4-(1,5-dimethylimidazol-4-yl)piperidine
SMILESCc1c(C2CCNCC2)ncn1C
InChIInChI=1S/C10H17N3/c1-8-10(12-7-13(8)2)9-3-5-11-6-4-9/h7,9,11H,3-6H2,1-2H3
InChIKeyKVQHWGVSHXNVFO-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.20
Rot. Bonds1

About 4-(1,5-dimethylimidazol-4-yl)piperidine

4-(1,5-dimethylimidazol-4-yl)piperidine (PubChem CID 84657143) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 4-(1,5-dimethylimidazol-4-yl)piperidine.

Molecular Properties

Compound Name4-(1,5-dimethylimidazol-4-yl)piperidine
PubChem CID84657143
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name4-(1,5-dimethylimidazol-4-yl)piperidine
SMILESCc1c(C2CCNCC2)ncn1C
InChIInChI=1S/C10H17N3/c1-8-10(12-7-13(8)2)9-3-5-11-6-4-9/h7,9,11H,3-6H2,1-2H3
InChIKeyKVQHWGVSHXNVFO-UHFFFAOYSA-N
XLogP1.20
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1,5-dimethylimidazol-4-yl)piperidine?
The IUPAC name of 4-(1,5-dimethylimidazol-4-yl)piperidine (CID 84657143) is 4-(1,5-dimethylimidazol-4-yl)piperidine.
What is the SMILES notation for 4-(1,5-dimethylimidazol-4-yl)piperidine?
The canonical SMILES for 4-(1,5-dimethylimidazol-4-yl)piperidine is Cc1c(C2CCNCC2)ncn1C.
What is the InChIKey of 4-(1,5-dimethylimidazol-4-yl)piperidine?
The InChIKey is KVQHWGVSHXNVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-10(12-7-13(8)2)9-3-5-11-6-4-9/h7,9,11H,3-6H2,1-2H3.
What are the key properties of 4-(1,5-dimethylimidazol-4-yl)piperidine?
4-(1,5-dimethylimidazol-4-yl)piperidine has a molecular weight of 179.27 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,5-dimethylimidazol-4-yl)piperidine is sourced from PubChem (CID 84657143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).