1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine

C10H17N — CID 134894494

IUPAC1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine
SMILESCC1=C2N(CC1)CCC2(C)C
InChIInChI=1S/C10H17N/c1-8-4-6-11-7-5-10(2,3)9(8)11/h4-7H2,1-3H3
InChIKeyBRJXVMOABNPNSH-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.40
Rot. Bonds

About 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine

1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine (PubChem CID 134894494) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine.

Molecular Properties

Compound Name1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine
PubChem CID134894494
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine
SMILESCC1=C2N(CC1)CCC2(C)C
InChIInChI=1S/C10H17N/c1-8-4-6-11-7-5-10(2,3)9(8)11/h4-7H2,1-3H3
InChIKeyBRJXVMOABNPNSH-UHFFFAOYSA-N
XLogP2.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine?
The IUPAC name of 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine (CID 134894494) is 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine.
What is the SMILES notation for 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine?
The canonical SMILES for 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine is CC1=C2N(CC1)CCC2(C)C.
What is the InChIKey of 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine?
The InChIKey is BRJXVMOABNPNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-8-4-6-11-7-5-10(2,3)9(8)11/h4-7H2,1-3H3.
What are the key properties of 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine?
1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine has a molecular weight of 151.25 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,7-trimethyl-2,3,5,6-tetrahydropyrrolizine is sourced from PubChem (CID 134894494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).