1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane

C14H24 — CID 123255014

IUPAC1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane
SMILESCC(C)C1C(C)C12CC2C1CCC1C
InChIInChI=1S/C14H24/c1-8(2)13-10(4)14(13)7-12(14)11-6-5-9(11)3/h8-13H,5-7H2,1-4H3
InChIKeyQFFITVSLUBJKPE-UHFFFAOYSA-N
MW192.35 g/mol
LogP3.96
Rot. Bonds2

About 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane

1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane (PubChem CID 123255014) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane.

Molecular Properties

Compound Name1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane
PubChem CID123255014
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane
SMILESCC(C)C1C(C)C12CC2C1CCC1C
InChIInChI=1S/C14H24/c1-8(2)13-10(4)14(13)7-12(14)11-6-5-9(11)3/h8-13H,5-7H2,1-4H3
InChIKeyQFFITVSLUBJKPE-UHFFFAOYSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1R,2S,6R)-1-methyl-2-propan-2-ylspiro[2.3]hexan-6-amine
CID 160599403
(1R,5S,6S)-2-methyl-5-propan-2-ylbicyclo[4.1.0]heptane
CID 143658128
2,6-dimethylbicyclo[3.2.0]heptane
CID 91170917
1,2-dimethylcyclobutane;2-methylpropane
CID 143728444
2-propan-2-yltricyclo[4.3.0.01,3]nonane
CID 143378138
(1S,4S)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 153428714
(4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;(4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;(4S,4aS,8aS)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;(4S,4aS,8aR)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 162070754
1,3-dimethyl-5-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 153382401
2-(2,5-dimethylcyclohexyl)-1,4-dimethylcyclohexane
CID 91483098
(1R)-1-methyl-2-propan-2-ylcyclobutane
CID 158704963
(2R)-2-[(7R)-4,7-dimethyl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridin-2-ium-2-yl]propanoate
CID 163141610
(2S)-2-[(7S)-4,7-dimethyl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridin-2-ium-2-yl]propanoate
CID 163141606

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane?
The IUPAC name of 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane (CID 123255014) is 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane.
What is the SMILES notation for 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane?
The canonical SMILES for 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane is CC(C)C1C(C)C12CC2C1CCC1C.
What is the InChIKey of 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane?
The InChIKey is QFFITVSLUBJKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-8(2)13-10(4)14(13)7-12(14)11-6-5-9(11)3/h8-13H,5-7H2,1-4H3.
What are the key properties of 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane?
1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane has a molecular weight of 192.35 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(2-methylcyclobutyl)-2-propan-2-ylspiro[2.2]pentane is sourced from PubChem (CID 123255014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).