7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane

C10H18N4 — CID 121451175

IUPAC7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane
SMILESC1CNC(N2CCC3(CC2)CNC3)=N1
InChIInChI=1S/C10H18N4/c1-5-14(9-12-3-4-13-9)6-2-10(1)7-11-8-10/h11H,1-8H2,(H,12,13)
InChIKeyJXYIESUXMSVDBB-UHFFFAOYSA-N
MW194.28 g/mol
LogP-0.37
Rot. Bonds

About 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane

7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane (PubChem CID 121451175) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane
PubChem CID121451175
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane
SMILESC1CNC(N2CCC3(CC2)CNC3)=N1
InChIInChI=1S/C10H18N4/c1-5-14(9-12-3-4-13-9)6-2-10(1)7-11-8-10/h11H,1-8H2,(H,12,13)
InChIKeyJXYIESUXMSVDBB-UHFFFAOYSA-N
XLogP-0.37
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane (CID 121451175) is 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane is C1CNC(N2CCC3(CC2)CNC3)=N1.
What is the InChIKey of 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane?
The InChIKey is JXYIESUXMSVDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-5-14(9-12-3-4-13-9)6-2-10(1)7-11-8-10/h11H,1-8H2,(H,12,13).
What are the key properties of 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane?
7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane has a molecular weight of 194.28 g/mol, XLogP of -0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4,5-dihydro-1H-imidazol-2-yl)-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 121451175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).