1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine

C10H19N3O — CID 43121960

IUPAC1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine
SMILES[H]/N=C1\CCCN1CCN1CCOCC1
InChIInChI=1S/C10H19N3O/c11-10-2-1-3-13(10)5-4-12-6-8-14-9-7-12/h11H,1-9H2/b11-10+
InChIKeyNCFVQXXQBXJFRZ-ZHACJKMWSA-N
MW197.28 g/mol
LogP0.39
Rot. Bonds3

About 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine

1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine (PubChem CID 43121960) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine
PubChem CID43121960
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine
SMILES[H]/N=C1\CCCN1CCN1CCOCC1
InChIInChI=1S/C10H19N3O/c11-10-2-1-3-13(10)5-4-12-6-8-14-9-7-12/h11H,1-9H2/b11-10+
InChIKeyNCFVQXXQBXJFRZ-ZHACJKMWSA-N
XLogP0.39
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine?
The IUPAC name of 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine (CID 43121960) is 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine is [H]/N=C1\CCCN1CCN1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine?
The InChIKey is NCFVQXXQBXJFRZ-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H19N3O/c11-10-2-1-3-13(10)5-4-12-6-8-14-9-7-12/h11H,1-9H2/b11-10+.
What are the key properties of 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine?
1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine has a molecular weight of 197.28 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)pyrrolidin-2-imine is sourced from PubChem (CID 43121960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).