10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane

C17H30 — CID 158433586

IUPAC10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane
SMILESCC(C)C1CC(C)C2CC3CCCC3CC1C2
InChIInChI=1S/C17H30/c1-11(2)17-7-12(3)15-8-13-5-4-6-14(13)9-16(17)10-15/h11-17H,4-10H2,1-3H3
InChIKeyHBYKJGKWFVLLMH-UHFFFAOYSA-N
MW234.43 g/mol
LogP5.13
Rot. Bonds1

About 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane

10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane (PubChem CID 158433586) has the molecular formula C17H30 and a molecular weight of 234.43 g/mol. Its IUPAC name is 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane.

Molecular Properties

Compound Name10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane
PubChem CID158433586
Molecular FormulaC17H30
Molecular Weight234.43 g/mol
Exact Mass234.23
IUPAC Name10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane
SMILESCC(C)C1CC(C)C2CC3CCCC3CC1C2
InChIInChI=1S/C17H30/c1-11(2)17-7-12(3)15-8-13-5-4-6-14(13)9-16(17)10-15/h11-17H,4-10H2,1-3H3
InChIKeyHBYKJGKWFVLLMH-UHFFFAOYSA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500234.43
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1S,4S)-2,5-di(propan-2-yl)bicyclo[2.2.1]heptane
CID 153291297
azane;1-methyl-2-propan-2-ylcyclopropane
CID 21258764
5,6-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 14415240
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
cis-(1S,2S)-1-methyl-2-propan-2-ylcyclopentane
CID 59954464
2,5-di(propan-2-yl)bicyclo[2.2.2]octane
CID 140828495
(1S)-1,2-di(propan-2-yl)cyclopentane
CID 161356354
bis(bicyclo[3.1.0]hexane);trihydrochloride
CID 69185190
tricyclo[4.3.1.12,5]undecane
CID 13070377
bicyclo[3.1.0]hexane;dihydrochloride
CID 141306080
(2S,5S)-2,5-dimethylbicyclo[2.2.1]heptane
CID 59124874
cis-(1S,2R)-1,2-dimethylcyclopropane;ethane;methane;trans-(1S,2R)-1-methyl-2-propan-2-ylcyclopropane
CID 158862378

Frequently Asked Questions

What is the IUPAC name of 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane?
The IUPAC name of 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane (CID 158433586) is 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane.
What is the SMILES notation for 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane?
The canonical SMILES for 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane is CC(C)C1CC(C)C2CC3CCCC3CC1C2.
What is the InChIKey of 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane?
The InChIKey is HBYKJGKWFVLLMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30/c1-11(2)17-7-12(3)15-8-13-5-4-6-14(13)9-16(17)10-15/h11-17H,4-10H2,1-3H3.
What are the key properties of 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane?
10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane has a molecular weight of 234.43 g/mol, XLogP of 5.13, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-12-propan-2-yltricyclo[7.3.1.03,7]tridecane is sourced from PubChem (CID 158433586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).