4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine

C13H25N3 — CID 142002089

IUPAC4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine
SMILESCC1=CN(CCCC2CCNCC2)C(C)N1
InChIInChI=1S/C13H25N3/c1-11-10-16(12(2)15-11)9-3-4-13-5-7-14-8-6-13/h10,12-15H,3-9H2,1-2H3
InChIKeyUCMAWDKCJZNBGS-UHFFFAOYSA-N
MW223.36 g/mol
LogP1.88
Rot. Bonds4

About 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine

4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine (PubChem CID 142002089) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine.

Molecular Properties

Compound Name4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine
PubChem CID142002089
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC Name4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine
SMILESCC1=CN(CCCC2CCNCC2)C(C)N1
InChIInChI=1S/C13H25N3/c1-11-10-16(12(2)15-11)9-3-4-13-5-7-14-8-6-13/h10,12-15H,3-9H2,1-2H3
InChIKeyUCMAWDKCJZNBGS-UHFFFAOYSA-N
XLogP1.88
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine?
The IUPAC name of 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine (CID 142002089) is 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine.
What is the SMILES notation for 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine?
The canonical SMILES for 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine is CC1=CN(CCCC2CCNCC2)C(C)N1.
What is the InChIKey of 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine?
The InChIKey is UCMAWDKCJZNBGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3/c1-11-10-16(12(2)15-11)9-3-4-13-5-7-14-8-6-13/h10,12-15H,3-9H2,1-2H3.
What are the key properties of 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine?
4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine has a molecular weight of 223.36 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine is sourced from PubChem (CID 142002089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).