8-methyl-1,2,3,7-tetrahydropyrrolizine

C8H13N — CID 175612350

IUPAC8-methyl-1,2,3,7-tetrahydropyrrolizine
SMILESCC12CC=CN1CCC2
InChIInChI=1S/C8H13N/c1-8-4-2-6-9(8)7-3-5-8/h2,6H,3-5,7H2,1H3
InChIKeyHUFKFFHKUXOUJR-UHFFFAOYSA-N
MW123.20 g/mol
LogP1.76
Rot. Bonds

About 8-methyl-1,2,3,7-tetrahydropyrrolizine

8-methyl-1,2,3,7-tetrahydropyrrolizine (PubChem CID 175612350) has the molecular formula C8H13N and a molecular weight of 123.20 g/mol. Its IUPAC name is 8-methyl-1,2,3,7-tetrahydropyrrolizine.

Molecular Properties

Compound Name8-methyl-1,2,3,7-tetrahydropyrrolizine
PubChem CID175612350
Molecular FormulaC8H13N
Molecular Weight123.20 g/mol
Exact Mass123.10
IUPAC Name8-methyl-1,2,3,7-tetrahydropyrrolizine
SMILESCC12CC=CN1CCC2
InChIInChI=1S/C8H13N/c1-8-4-2-6-9(8)7-3-5-8/h2,6H,3-5,7H2,1H3
InChIKeyHUFKFFHKUXOUJR-UHFFFAOYSA-N
XLogP1.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.20
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(5R)-2,2,5-trimethyl-1-[(E)-3-methylbut-1-enyl]pyrrolidine
CID 134850244
1,2-Bis(ethenyl)-2-methylpyrrolidine
CID 134972345
(2S)-1,2-bis(ethenyl)-2-methylpyrrolidine
CID 134972463
1,2-Dimethyl-2-prop-2-enylpyrrolidine
CID 58293407
(5S,6S)-5,6-di(propan-2-yl)-1-azabicyclo[2.2.1]hept-2-ene
CID 89244519
1,2-Dimethyl-2-prop-2-enylpyrrolidine;ethane
CID 123564390
1-Ethyl-1-azaspiro[4.4]non-2-ene
CID 138612111
1-methyl-3,3a,3b,4-tetrahydro-2H-pyrrolo[3,2-a]pyrrolizine
CID 150386208
1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine
CID 155329325
2-But-3-enyl-2-ethyl-1-methylpyrrolidine
CID 162743087
(2S)-1-ethyl-2-methyl-2-prop-2-enylpyrrolidine
CID 163799784
(2R,4S)-1-ethenyl-2-methyl-4-prop-2-enylpyrrolidine
CID 170049974

Frequently Asked Questions

What is the IUPAC name of 8-methyl-1,2,3,7-tetrahydropyrrolizine?
The IUPAC name of 8-methyl-1,2,3,7-tetrahydropyrrolizine (CID 175612350) is 8-methyl-1,2,3,7-tetrahydropyrrolizine.
What is the SMILES notation for 8-methyl-1,2,3,7-tetrahydropyrrolizine?
The canonical SMILES for 8-methyl-1,2,3,7-tetrahydropyrrolizine is CC12CC=CN1CCC2.
What is the InChIKey of 8-methyl-1,2,3,7-tetrahydropyrrolizine?
The InChIKey is HUFKFFHKUXOUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N/c1-8-4-2-6-9(8)7-3-5-8/h2,6H,3-5,7H2,1H3.
What are the key properties of 8-methyl-1,2,3,7-tetrahydropyrrolizine?
8-methyl-1,2,3,7-tetrahydropyrrolizine has a molecular weight of 123.20 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1,2,3,7-tetrahydropyrrolizine is sourced from PubChem (CID 175612350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).