2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]

C15H24 — CID 163444946

IUPAC2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]
SMILESCC1C2CCCCC2CCC2C1C21CC1
InChIInChI=1S/C15H24/c1-10-12-5-3-2-4-11(12)6-7-13-14(10)15(13)8-9-15/h10-14H,2-9H2,1H3
InChIKeyBBSMWPXEDJOIFI-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.25
Rot. Bonds

About 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]

2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane] (PubChem CID 163444946) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane].

Molecular Properties

Compound Name2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]
PubChem CID163444946
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]
SMILESCC1C2CCCCC2CCC2C1C21CC1
InChIInChI=1S/C15H24/c1-10-12-5-3-2-4-11(12)6-7-13-14(10)15(13)8-9-15/h10-14H,2-9H2,1H3
InChIKeyBBSMWPXEDJOIFI-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane] with MolForge

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Related Compounds

1,2-dimethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 565551
(3aR)-1-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 134864690
(1R,3aS,7aR)-1-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 12701541
(1R,7aR)-1-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 59207141
carbanide;1-(1-cyclopentylcyclobutyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;zirconium(4+)
CID 162298132
1,3-dicyclohexyl-2,7-dimethylcyclodecane
CID 20676902
1-methyl-2-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 142470319
2-ethyl-1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 58552208
8,8-dimethoxy-2,3,4,4a,4b,5,6,7,8a,9,10,10a-dodecahydro-1H-phenanthrene
CID 176883882
1-(4-cyclohexylcyclohexyl)-2,3-dimethyl-4-(4-methylcyclohexyl)cyclohexane
CID 143294229
1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthrene;methane
CID 159429380
1,2-dimethyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthrene
CID 143144045

Frequently Asked Questions

What is the IUPAC name of 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]?
The IUPAC name of 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane] (CID 163444946) is 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane].
What is the SMILES notation for 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]?
The canonical SMILES for 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane] is CC1C2CCCCC2CCC2C1C21CC1.
What is the InChIKey of 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]?
The InChIKey is BBSMWPXEDJOIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-10-12-5-3-2-4-11(12)6-7-13-14(10)15(13)8-9-15/h10-14H,2-9H2,1H3.
What are the key properties of 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane]?
2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane] has a molecular weight of 204.36 g/mol, XLogP of 4.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-methylspiro[cyclopropane-1,4'-tricyclo[6.4.0.03,5]dodecane] is sourced from PubChem (CID 163444946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).