spiro[bicyclo[4.1.0]heptane-2,3'-piperidine]

C11H19N — CID 83873409

IUPACspiro[bicyclo[4.1.0]heptane-2,3'-piperidine]
SMILESC1CNCC2(C1)CCCC1CC12
InChIInChI=1S/C11H19N/c1-3-9-7-10(9)11(4-1)5-2-6-12-8-11/h9-10,12H,1-8H2
InChIKeySZZCLEWTVQDIFR-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.18
Rot. Bonds

About spiro[bicyclo[4.1.0]heptane-2,3'-piperidine]

spiro[bicyclo[4.1.0]heptane-2,3'-piperidine] (PubChem CID 83873409) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is spiro[bicyclo[4.1.0]heptane-2,3'-piperidine].

Molecular Properties

Compound Namespiro[bicyclo[4.1.0]heptane-2,3'-piperidine]
PubChem CID83873409
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Namespiro[bicyclo[4.1.0]heptane-2,3'-piperidine]
SMILESC1CNCC2(C1)CCCC1CC12
InChIInChI=1S/C11H19N/c1-3-9-7-10(9)11(4-1)5-2-6-12-8-11/h9-10,12H,1-8H2
InChIKeySZZCLEWTVQDIFR-UHFFFAOYSA-N
XLogP2.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

spiro[bicyclo[4.1.0]heptane-2,1'-cyclopentane]
CID 140625385
2-cyclopentyl-5-azaspiro[2.4]heptane
CID 115013095
(4R)-3-tert-butyl-6-azaspiro[3.5]nonane
CID 171594443
1-(6-azaspiro[3.5]nonan-9-yl)-8-(1,3-diazecan-7-yl)-2-azaspiro[4.5]decane
CID 138518246
5-cyclopentyl-3-azaspiro[5.6]dodecane
CID 112570787
(3R,4aR,8aS)-3-methylspiro[2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalene-8,1'-cyclohexane]
CID 58376158
6-azaspiro[3.5]nonan-9-ol
CID 82418041
(1R,6S)-2,2-difluorobicyclo[4.1.0]heptane
CID 163491628
5-azaspiro[2.5]octane-2-carboxylic acid;hydrochloride
CID 122163372
2-(2-fluoropropan-2-yl)-5-azaspiro[2.5]octane
CID 115013917
2-azaspiro[3.5]nonan-5-ol
CID 167738706
(1R,2S,6R)-2-methylbicyclo[4.1.0]heptan-2-ol
CID 98172819

Frequently Asked Questions

What is the IUPAC name of spiro[bicyclo[4.1.0]heptane-2,3'-piperidine]?
The IUPAC name of spiro[bicyclo[4.1.0]heptane-2,3'-piperidine] (CID 83873409) is spiro[bicyclo[4.1.0]heptane-2,3'-piperidine].
What is the SMILES notation for spiro[bicyclo[4.1.0]heptane-2,3'-piperidine]?
The canonical SMILES for spiro[bicyclo[4.1.0]heptane-2,3'-piperidine] is C1CNCC2(C1)CCCC1CC12.
What is the InChIKey of spiro[bicyclo[4.1.0]heptane-2,3'-piperidine]?
The InChIKey is SZZCLEWTVQDIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-3-9-7-10(9)11(4-1)5-2-6-12-8-11/h9-10,12H,1-8H2.
What are the key properties of spiro[bicyclo[4.1.0]heptane-2,3'-piperidine]?
spiro[bicyclo[4.1.0]heptane-2,3'-piperidine] has a molecular weight of 165.28 g/mol, XLogP of 2.18, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[bicyclo[4.1.0]heptane-2,3'-piperidine] is sourced from PubChem (CID 83873409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).