8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine

C12H23N — CID 176937672

IUPAC8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine
SMILESCC(C)C1CN2CCCCC2(C)C1
InChIInChI=1S/C12H23N/c1-10(2)11-8-12(3)6-4-5-7-13(12)9-11/h10-11H,4-9H2,1-3H3
InChIKeyJRAPWKPTLJCVKL-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.91
Rot. Bonds1

About 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine

8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine (PubChem CID 176937672) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine.

Molecular Properties

Compound Name8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine
PubChem CID176937672
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine
SMILESCC(C)C1CN2CCCCC2(C)C1
InChIInChI=1S/C12H23N/c1-10(2)11-8-12(3)6-4-5-7-13(12)9-11/h10-11H,4-9H2,1-3H3
InChIKeyJRAPWKPTLJCVKL-UHFFFAOYSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 64950737
(2R,8S)-2-fluoro-8-methyl-1,2,3,5,6,7-hexahydropyrrolizine;methane
CID 164903957
(8S)-8-methyl-1,2,3,5,6,7-hexahydropyrrolizine-2-carbonitrile
CID 171595552
1-(1,3,4-trimethylcyclohexyl)pyrrolidine
CID 68655889
1-[(1R,3S,4R)-1,3,4-trimethylcyclohexyl]pyrrolidine
CID 66694576
1-(3-propan-2-ylazetidin-1-yl)cycloheptane-1-carboxylic acid
CID 79694842
5-cyclopropyl-2-propan-2-yl-5-azaspiro[3.5]nonane
CID 164867855
1-(1-methylcyclopentyl)-3-(2-methylpropyl)piperazine
CID 64953652
8a-methyl-2,3,5,6,7,8-hexahydro-1H-indolizin-7-amine
CID 90440112
2-(1-methylcyclohexyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929015
(8R)-6-methyl-8-propan-2-yl-6-azaspiro[3.5]nonane
CID 129290560

Frequently Asked Questions

What is the IUPAC name of 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine?
The IUPAC name of 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine (CID 176937672) is 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine.
What is the SMILES notation for 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine?
The canonical SMILES for 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine is CC(C)C1CN2CCCCC2(C)C1.
What is the InChIKey of 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine?
The InChIKey is JRAPWKPTLJCVKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-10(2)11-8-12(3)6-4-5-7-13(12)9-11/h10-11H,4-9H2,1-3H3.
What are the key properties of 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine?
8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine has a molecular weight of 181.32 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8a-methyl-2-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-indolizine is sourced from PubChem (CID 176937672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).