3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane

C15H28 — CID 123562796

IUPAC3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane
SMILESCCCC1C(C)CC2CC(C)CC1C2C
InChIInChI=1S/C15H28/c1-5-6-14-11(3)9-13-7-10(2)8-15(14)12(13)4/h10-15H,5-9H2,1-4H3
InChIKeyLATJFHRNQVOONB-UHFFFAOYSA-N
MW208.39 g/mol
LogP4.74
Rot. Bonds2

About 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane

3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane (PubChem CID 123562796) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane.

Molecular Properties

Compound Name3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane
PubChem CID123562796
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane
SMILESCCCC1C(C)CC2CC(C)CC1C2C
InChIInChI=1S/C15H28/c1-5-6-14-11(3)9-13-7-10(2)8-15(14)12(13)4/h10-15H,5-9H2,1-4H3
InChIKeyLATJFHRNQVOONB-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.39
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-methyl-2,4-dipropylbicyclo[3.1.0]hexane
CID 21354381
2,5-dimethyl-3-propylbicyclo[2.2.0]hexane
CID 91214227
(1R,4S)-2-methyl-3-propylbicyclo[2.2.1]heptane
CID 58729228
3,6-dimethyl-2-pentyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1-thiol
CID 135265546
1,3-diethyl-4-methyl-2-propylcyclopentane
CID 143310394
1,2,4,5,6,7-hexamethyl-3-propyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulene
CID 59116018
1,2,3-trimethyl-4-propylcyclobutane
CID 90876457
1,2,3,4-tetramethyl-5-propylcyclopentane
CID 23231337
2,4,5,6-tetramethyl-3-propyl-1,1a,2,2a,3,4,5,5a,6,6a-decahydrocyclopropa[f]indene
CID 59917128
1,3-dimethyl-5-propylcyclohexane
CID 13144142
7-ethyl-5-[7-ethyl-5-[7-ethyl-2-(7-ethyl-2-methyl-2,3,3a,3b,4,5,6,6a,7,7a-decahydro-1H-cyclopenta[a]pentalen-5-yl)-2,3,3a,3b,4,5,6,6a,7,7a-decahydro-1H-cyclopenta[a]pentalen-5-yl]-2,3,3a,3b,4,5,6,6a,7,7a-decahydro-1H-cyclopenta[a]pentalen-2-yl]-2-methyl-2,3,3a,3b,4,5,6,6a,7,7a-decahydro-1H-cyclopenta[a]pentalene
CID 164793601
1,4-dimethyl-2-propylcyclopentane;ethane
CID 155717345

Frequently Asked Questions

What is the IUPAC name of 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane?
The IUPAC name of 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane (CID 123562796) is 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane.
What is the SMILES notation for 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane?
The canonical SMILES for 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane is CCCC1C(C)CC2CC(C)CC1C2C.
What is the InChIKey of 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane?
The InChIKey is LATJFHRNQVOONB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-5-6-14-11(3)9-13-7-10(2)8-15(14)12(13)4/h10-15H,5-9H2,1-4H3.
What are the key properties of 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane?
3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane has a molecular weight of 208.39 g/mol, XLogP of 4.74, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7,9-trimethyl-2-propylbicyclo[3.3.1]nonane is sourced from PubChem (CID 123562796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).