1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine

C12H23N3 — CID 59176371

IUPAC1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine
SMILESCC(C)CC1CCN(C2=NCCN2)CC1
InChIInChI=1S/C12H23N3/c1-10(2)9-11-3-7-15(8-4-11)12-13-5-6-14-12/h10-11H,3-9H2,1-2H3,(H,13,14)
InChIKeyRSSWLNBGZRAAQC-UHFFFAOYSA-N
MW209.34 g/mol
LogP1.70
Rot. Bonds2

About 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine

1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine (PubChem CID 59176371) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine
PubChem CID59176371
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine
SMILESCC(C)CC1CCN(C2=NCCN2)CC1
InChIInChI=1S/C12H23N3/c1-10(2)9-11-3-7-15(8-4-11)12-13-5-6-14-12/h10-11H,3-9H2,1-2H3,(H,13,14)
InChIKeyRSSWLNBGZRAAQC-UHFFFAOYSA-N
XLogP1.70
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine?
The IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine (CID 59176371) is 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine.
What is the SMILES notation for 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine?
The canonical SMILES for 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine is CC(C)CC1CCN(C2=NCCN2)CC1.
What is the InChIKey of 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine?
The InChIKey is RSSWLNBGZRAAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-10(2)9-11-3-7-15(8-4-11)12-13-5-6-14-12/h10-11H,3-9H2,1-2H3,(H,13,14).
What are the key properties of 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine?
1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine has a molecular weight of 209.34 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1H-imidazol-2-yl)-4-(2-methylpropyl)piperidine is sourced from PubChem (CID 59176371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).