morpholin-4-yl(pyrrolidin-1-yl)methanimine

C9H17N3O — CID 176964346

IUPACmorpholin-4-yl(pyrrolidin-1-yl)methanimine
SMILES[H]/N=C(\N1CCCC1)N1CCOCC1
InChIInChI=1S/C9H17N3O/c10-9(11-3-1-2-4-11)12-5-7-13-8-6-12/h10H,1-8H2/b10-9+
InChIKeyPEDTWHNMLQAGFA-MDZDMXLPSA-N
MW183.25 g/mol
LogP0.35
Rot. Bonds

About morpholin-4-yl(pyrrolidin-1-yl)methanimine

morpholin-4-yl(pyrrolidin-1-yl)methanimine (PubChem CID 176964346) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is morpholin-4-yl(pyrrolidin-1-yl)methanimine.

Molecular Properties

Compound Namemorpholin-4-yl(pyrrolidin-1-yl)methanimine
PubChem CID176964346
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Namemorpholin-4-yl(pyrrolidin-1-yl)methanimine
SMILES[H]/N=C(\N1CCCC1)N1CCOCC1
InChIInChI=1S/C9H17N3O/c10-9(11-3-1-2-4-11)12-5-7-13-8-6-12/h10H,1-8H2/b10-9+
InChIKeyPEDTWHNMLQAGFA-MDZDMXLPSA-N
XLogP0.35
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-(Pyrrolidin-1-ylmethyl)morpholine
CID 21651133
N,N-diethylmorpholine-4-carboximidamide
CID 90350361
N,N-dimethylmorpholine-4-carboximidamide;ethane
CID 145053354
Pyrrolidin-1-yl morpholine-4-carboximidothioate
CID 146817389
ethane;N-methyl-1-morpholin-4-yl-1-pyrrolidin-1-ylmethanimine
CID 163296307
N-methyl-1-morpholin-4-yl-1-pyrrolidin-1-ylmethanimine
CID 163296308
1-morpholin-4-yl-N-propan-2-yl-1-pyrrolidin-1-ylmethanimine
CID 169963498
N-[amino(pyrrolidin-1-yl)methylidene]morpholine-4-carboximidamide
CID 173898165
ethane;N-methyl-1-morpholin-4-yl-1-pyrrolidin-1-ylmethanimine
CID 176964319
N-methyl-1-morpholin-4-yl-1-pyrrolidin-1-ylmethanimine;propane
CID 176964320
Ethane;morpholin-4-yl(pyrrolidin-1-yl)methanimine
CID 177369366
1-(3-Morpholin-4-ylpropyl)pyrrolidin-2-imine
CID 43348237

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(pyrrolidin-1-yl)methanimine?
The IUPAC name of morpholin-4-yl(pyrrolidin-1-yl)methanimine (CID 176964346) is morpholin-4-yl(pyrrolidin-1-yl)methanimine.
What is the SMILES notation for morpholin-4-yl(pyrrolidin-1-yl)methanimine?
The canonical SMILES for morpholin-4-yl(pyrrolidin-1-yl)methanimine is [H]/N=C(\N1CCCC1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(pyrrolidin-1-yl)methanimine?
The InChIKey is PEDTWHNMLQAGFA-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H17N3O/c10-9(11-3-1-2-4-11)12-5-7-13-8-6-12/h10H,1-8H2/b10-9+.
What are the key properties of morpholin-4-yl(pyrrolidin-1-yl)methanimine?
morpholin-4-yl(pyrrolidin-1-yl)methanimine has a molecular weight of 183.25 g/mol, XLogP of 0.35, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(pyrrolidin-1-yl)methanimine is sourced from PubChem (CID 176964346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).