7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine

C11H21N — CID 152845359

IUPAC7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine
SMILESCC1(C)CCN2CCCC2(C)C1
InChIInChI=1S/C11H21N/c1-10(2)6-8-12-7-4-5-11(12,3)9-10/h4-9H2,1-3H3
InChIKeyTTXYODDBHVRPRP-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.66
Rot. Bonds

About 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine

7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine (PubChem CID 152845359) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine.

Molecular Properties

Compound Name7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine
PubChem CID152845359
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine
SMILESCC1(C)CCN2CCCC2(C)C1
InChIInChI=1S/C11H21N/c1-10(2)6-8-12-7-4-5-11(12,3)9-10/h4-9H2,1-3H3
InChIKeyTTXYODDBHVRPRP-UHFFFAOYSA-N
XLogP2.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1,5,6-trimethyl-2-azatricyclo[4.3.3.22,5]tetradecane
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1-(1-methylcyclopentyl)-1,4-diazepane
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8a-methyl-2,3,5,6,7,8-hexahydro-1H-indolizin-7-amine
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1-methyl-4-(1-methylcycloheptyl)piperazine
CID 71065653
8a-methyl-1,2,3,5,6,8-hexahydroindolizin-7-imine
CID 90440151
1-(3,3-diethyl-1,5,5-trimethylcyclohexyl)piperidine
CID 10264855
1-(1-methylcyclobutyl)-4-(2,3,3-trimethylbutan-2-yl)piperazine
CID 129119921
(2R)-2,8-dimethyl-1,2,3,5,6,7-hexahydropyrrolizine
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1-[(1R,5R)-5-ethyl-1,3,3-trimethylcyclohexyl]pyrrolidine
CID 66759552
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CID 164903957

Frequently Asked Questions

What is the IUPAC name of 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine?
The IUPAC name of 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine (CID 152845359) is 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine.
What is the SMILES notation for 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine?
The canonical SMILES for 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine is CC1(C)CCN2CCCC2(C)C1.
What is the InChIKey of 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine?
The InChIKey is TTXYODDBHVRPRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-10(2)6-8-12-7-4-5-11(12,3)9-10/h4-9H2,1-3H3.
What are the key properties of 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine?
7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine has a molecular weight of 167.30 g/mol, XLogP of 2.66, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,8a-trimethyl-1,2,3,5,6,8-hexahydroindolizine is sourced from PubChem (CID 152845359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).