8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane

C12H21N3 — CID 58525397

IUPAC8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane
SMILESC1CCC2(C1)CCN(C1=NCCN1)CC2
InChIInChI=1S/C12H21N3/c1-2-4-12(3-1)5-9-15(10-6-12)11-13-7-8-14-11/h1-10H2,(H,13,14)
InChIKeyFLDSRYOHOWVARJ-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.60
Rot. Bonds

About 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane

8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane (PubChem CID 58525397) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane
PubChem CID58525397
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane
SMILESC1CCC2(C1)CCN(C1=NCCN1)CC2
InChIInChI=1S/C12H21N3/c1-2-4-12(3-1)5-9-15(10-6-12)11-13-7-8-14-11/h1-10H2,(H,13,14)
InChIKeyFLDSRYOHOWVARJ-UHFFFAOYSA-N
XLogP1.60
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane?
The IUPAC name of 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane (CID 58525397) is 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane?
The canonical SMILES for 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane is C1CCC2(C1)CCN(C1=NCCN1)CC2.
What is the InChIKey of 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane?
The InChIKey is FLDSRYOHOWVARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-2-4-12(3-1)5-9-15(10-6-12)11-13-7-8-14-11/h1-10H2,(H,13,14).
What are the key properties of 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane?
8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane has a molecular weight of 207.32 g/mol, XLogP of 1.60, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4,5-dihydro-1H-imidazol-2-yl)-8-azaspiro[4.5]decane is sourced from PubChem (CID 58525397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).