8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline

C18H33N — CID 162503082

IUPAC8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline
SMILESCC1C(C)C(C)C(C2CCCC3CCCNC32)C1C
InChIInChI=1S/C18H33N/c1-11-12(2)14(4)17(13(11)3)16-9-5-7-15-8-6-10-19-18(15)16/h11-19H,5-10H2,1-4H3
InChIKeyLMFSQDFMLCBIMQ-UHFFFAOYSA-N
MW263.47 g/mol
LogP4.33
Rot. Bonds1

About 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline

8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline (PubChem CID 162503082) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline.

Molecular Properties

Compound Name8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline
PubChem CID162503082
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC Name8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline
SMILESCC1C(C)C(C)C(C2CCCC3CCCNC32)C1C
InChIInChI=1S/C18H33N/c1-11-12(2)14(4)17(13(11)3)16-9-5-7-15-8-6-10-19-18(15)16/h11-19H,5-10H2,1-4H3
InChIKeyLMFSQDFMLCBIMQ-UHFFFAOYSA-N
XLogP4.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.47
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline with MolForge

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Related Compounds

7-methyl-2-azabicyclo[4.1.0]heptane
CID 117045891
(6S)-7,8-dimethyl-2-azabicyclo[4.2.0]octane
CID 155110799
18-[5-(2-azabicyclo[8.7.0]heptadecan-17-yl)cyclooctyl]-2-azabicyclo[8.8.0]octadecane
CID 137398080
16-cycloundecyl-2-azabicyclo[7.7.0]hexadecane
CID 137397804
2-cycloheptyl-3-methylpiperidine
CID 84720602
(3aR,7R,7aS)-7-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole
CID 124603442
2-cyclobutylpiperidin-3-ol
CID 115012112
5,7-dimethyl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[b]pyridine;ethane;methane
CID 157051839
2-cyclopentyl-3-fluoropiperidine
CID 84717416
1,2,3,4,4a,5,5a,6,7,8,8a,8b-dodecahydropentaleno[2,1-b]pyridine
CID 112714334
2-cyclobutyl-3-cyclopropylazetidine
CID 131197284
1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-8-carboxamide
CID 16781900

Frequently Asked Questions

What is the IUPAC name of 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline?
The IUPAC name of 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline (CID 162503082) is 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline.
What is the SMILES notation for 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline?
The canonical SMILES for 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline is CC1C(C)C(C)C(C2CCCC3CCCNC32)C1C.
What is the InChIKey of 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline?
The InChIKey is LMFSQDFMLCBIMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N/c1-11-12(2)14(4)17(13(11)3)16-9-5-7-15-8-6-10-19-18(15)16/h11-19H,5-10H2,1-4H3.
What are the key properties of 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline?
8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline has a molecular weight of 263.47 g/mol, XLogP of 4.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,3,4,5-tetramethylcyclopentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline is sourced from PubChem (CID 162503082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).