5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole

C14H20N2O — CID 116811722

IUPAC5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole
SMILESc1ncn(C2CCOC3(CCC3)C2)c1C1CC1
InChIInChI=1S/C14H20N2O/c1-5-14(6-1)8-12(4-7-17-14)16-10-15-9-13(16)11-2-3-11/h9-12H,1-8H2
InChIKeyFVLXRLLLXVWKBX-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.03
Rot. Bonds2

About 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole

5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole (PubChem CID 116811722) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole.

Molecular Properties

Compound Name5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole
PubChem CID116811722
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole
SMILESc1ncn(C2CCOC3(CCC3)C2)c1C1CC1
InChIInChI=1S/C14H20N2O/c1-5-14(6-1)8-12(4-7-17-14)16-10-15-9-13(16)11-2-3-11/h9-12H,1-8H2
InChIKeyFVLXRLLLXVWKBX-UHFFFAOYSA-N
XLogP3.03
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-oxaspiro[3.5]nonan-8-yl)imidazol-4-amine
CID 165465012
2-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole
CID 79919368
1-(5-oxaspiro[3.5]nonan-8-yl)-1,2,4-triazole-3-carbonitrile
CID 79920603
5,6-dimethyl-1-(6-oxaspiro[4.5]decan-9-yl)benzimidazole
CID 116618591
3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrazole
CID 79920836
2-[3-(2,2-dimethyloxan-4-yl)imidazol-4-yl]morpholine
CID 114721565
2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)imidazole-4-sulfonamide
CID 81340557
5-oxaspiro[3.5]nonan-8-yl-(3-propan-2-ylimidazol-4-yl)methanol
CID 79913885
5-iodo-2-(5-oxaspiro[3.5]nonan-8-yl)pyridazin-3-one
CID 114553457
3-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)azetidin-3-ol
CID 79920651
N-[[1-(5-oxaspiro[3.5]nonan-8-yl)pyrazol-4-yl]methyl]propan-2-amine
CID 79920806
4-(1-chloroethyl)-1-(5-oxaspiro[3.5]nonan-8-yl)pyrazole
CID 79919589

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole?
The IUPAC name of 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole (CID 116811722) is 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole.
What is the SMILES notation for 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole?
The canonical SMILES for 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole is c1ncn(C2CCOC3(CCC3)C2)c1C1CC1.
What is the InChIKey of 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole?
The InChIKey is FVLXRLLLXVWKBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-5-14(6-1)8-12(4-7-17-14)16-10-15-9-13(16)11-2-3-11/h9-12H,1-8H2.
What are the key properties of 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole?
5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole has a molecular weight of 232.33 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-(5-oxaspiro[3.5]nonan-8-yl)imidazole is sourced from PubChem (CID 116811722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).