1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]

C11H16 — CID 163551381

IUPAC1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]
SMILESCC1C2CC3C(C34CC4)C12C
InChIInChI=1S/C11H16/c1-6-7-5-8-9(10(6,7)2)11(8)3-4-11/h6-9H,3-5H2,1-2H3
InChIKeyFJIMSSLHHBKGTG-UHFFFAOYSA-N
MW148.25 g/mol
LogP2.69
Rot. Bonds

About 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]

1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane] (PubChem CID 163551381) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane].

Molecular Properties

Compound Name1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]
PubChem CID163551381
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]
SMILESCC1C2CC3C(C34CC4)C12C
InChIInChI=1S/C11H16/c1-6-7-5-8-9(10(6,7)2)11(8)3-4-11/h6-9H,3-5H2,1-2H3
InChIKeyFJIMSSLHHBKGTG-UHFFFAOYSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane] with MolForge

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Related Compounds

1-methyltricyclo[2.1.0.02,5]pentane
CID 86129037
2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane
CID 123838216
CID 163462988
CID 163462988
7-methyltricyclo[3.3.0.01,4]octane
CID 148884206
1,2,3,6-tetramethylbicyclo[2.2.0]hexane
CID 123570801
2-methylbicyclo[1.1.0]butan-2-ol
CID 123776938
1,6-dimethylbicyclo[3.1.0]hexane;methane
CID 173302897
(1S,2R,6R,7R)-2-methoxy-1,7-dimethylbicyclo[4.1.0]heptane
CID 98172812
(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol
CID 143765864
2,3,6,8-tetramethyltricyclo[5.3.1.03,8]undecane
CID 155607777
azane;1,6-dimethylbicyclo[3.1.0]hexane;hydrochloride
CID 174569895
1,3,3,7-tetramethyl-2-oxabicyclo[2.2.1]heptane
CID 556904

Frequently Asked Questions

What is the IUPAC name of 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]?
The IUPAC name of 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane] (CID 163551381) is 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane].
What is the SMILES notation for 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]?
The canonical SMILES for 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane] is CC1C2CC3C(C34CC4)C12C.
What is the InChIKey of 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]?
The InChIKey is FJIMSSLHHBKGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-6-7-5-8-9(10(6,7)2)11(8)3-4-11/h6-9H,3-5H2,1-2H3.
What are the key properties of 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]?
1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane] has a molecular weight of 148.25 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane] is sourced from PubChem (CID 163551381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).