(4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine

C10H19N3O — CID 79089577

IUPAC(4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine
SMILES[H]/N=C(/C1CN(C)CCO1)N1CCCC1
InChIInChI=1S/C10H19N3O/c1-12-6-7-14-9(8-12)10(11)13-4-2-3-5-13/h9,11H,2-8H2,1H3/b11-10-
InChIKeyZELLGJRTCSZTRA-KHPPLWFESA-N
MW197.28 g/mol
LogP0.39
Rot. Bonds1

About (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine

(4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine (PubChem CID 79089577) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine.

Molecular Properties

Compound Name(4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine
PubChem CID79089577
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name(4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine
SMILES[H]/N=C(/C1CN(C)CCO1)N1CCCC1
InChIInChI=1S/C10H19N3O/c1-12-6-7-14-9(8-12)10(11)13-4-2-3-5-13/h9,11H,2-8H2,1H3/b11-10-
InChIKeyZELLGJRTCSZTRA-KHPPLWFESA-N
XLogP0.39
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
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'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine?
The IUPAC name of (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine (CID 79089577) is (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine.
What is the SMILES notation for (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine?
The canonical SMILES for (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine is [H]/N=C(/C1CN(C)CCO1)N1CCCC1.
What is the InChIKey of (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine?
The InChIKey is ZELLGJRTCSZTRA-KHPPLWFESA-N. The full InChI is InChI=1S/C10H19N3O/c1-12-6-7-14-9(8-12)10(11)13-4-2-3-5-13/h9,11H,2-8H2,1H3/b11-10-.
What are the key properties of (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine?
(4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine has a molecular weight of 197.28 g/mol, XLogP of 0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-2-yl)-pyrrolidin-1-ylmethanimine is sourced from PubChem (CID 79089577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).