(3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine

C10H17N — CID 138726527

IUPAC(3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine
SMILESC=C1/C(=C/C)C[C@@H](C)N1CC
InChIInChI=1S/C10H17N/c1-5-10-7-8(3)11(6-2)9(10)4/h5,8H,4,6-7H2,1-3H3/b10-5+/t8-/m1/s1
InChIKeyZQTVIQITVHPXBE-LLIKBPFYSA-N
MW151.25 g/mol
LogP2.56
Rot. Bonds1

About (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine

(3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine (PubChem CID 138726527) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine.

Molecular Properties

Compound Name(3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine
PubChem CID138726527
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine
SMILESC=C1/C(=C/C)C[C@@H](C)N1CC
InChIInChI=1S/C10H17N/c1-5-10-7-8(3)11(6-2)9(10)4/h5,8H,4,6-7H2,1-3H3/b10-5+/t8-/m1/s1
InChIKeyZQTVIQITVHPXBE-LLIKBPFYSA-N
XLogP2.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine?
The IUPAC name of (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine (CID 138726527) is (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine.
What is the SMILES notation for (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine?
The canonical SMILES for (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine is C=C1/C(=C/C)C[C@@H](C)N1CC.
What is the InChIKey of (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine?
The InChIKey is ZQTVIQITVHPXBE-LLIKBPFYSA-N. The full InChI is InChI=1S/C10H17N/c1-5-10-7-8(3)11(6-2)9(10)4/h5,8H,4,6-7H2,1-3H3/b10-5+/t8-/m1/s1.
What are the key properties of (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine?
(3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine has a molecular weight of 151.25 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5R)-1-ethyl-3-ethylidene-5-methyl-2-methylidenepyrrolidine is sourced from PubChem (CID 138726527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).