1-morpholin-4-ylethanimine

C6H12N2O — CID 18727554

IUPAC1-morpholin-4-ylethanimine
SMILES[H]/N=C(\C)N1CCOCC1
InChIInChI=1S/C6H12N2O/c1-6(7)8-2-4-9-5-3-8/h7H,2-5H2,1H3/b7-6+
InChIKeyRRWOHAJPXCZQDX-VOTSOKGWSA-N
MW128.18 g/mol
LogP0.32
Rot. Bonds

About 1-morpholin-4-ylethanimine

1-morpholin-4-ylethanimine (PubChem CID 18727554) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is 1-morpholin-4-ylethanimine.

Molecular Properties

Compound Name1-morpholin-4-ylethanimine
PubChem CID18727554
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC Name1-morpholin-4-ylethanimine
SMILES[H]/N=C(\C)N1CCOCC1
InChIInChI=1S/C6H12N2O/c1-6(7)8-2-4-9-5-3-8/h7H,2-5H2,1H3/b7-6+
InChIKeyRRWOHAJPXCZQDX-VOTSOKGWSA-N
XLogP0.32
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 50.32
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

Morpholinoamidine
CID 205053
Morpholine-4-carboselenoamide
CID 12008371
2-Morpholinoacetimidamide
CID 14547438
(E)-N-fluoro-1-morpholin-4-ylethanimine
CID 142610922
2-Imino-2-morpholinoacetonitrile
CID 10176175
2,2,2-Trifluoro-1-(morpholin-4-yl)ethan-1-imine
CID 12864059
2-Imino-2-morpholinoethanethiol
CID 45088634
2-Fluoro-1-morpholin-4-ylethanimine
CID 143430926
Methyl 4-morpholinecarboximidate
CID 13531143
3-Imino-3-morpholin-4-ylpropanenitrile
CID 14144303
1-Morpholin-4-ylpropan-1-imine
CID 17832333
N-methyl-1-morpholin-4-ylethanimine
CID 18335014

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-ylethanimine?
The IUPAC name of 1-morpholin-4-ylethanimine (CID 18727554) is 1-morpholin-4-ylethanimine.
What is the SMILES notation for 1-morpholin-4-ylethanimine?
The canonical SMILES for 1-morpholin-4-ylethanimine is [H]/N=C(\C)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-ylethanimine?
The InChIKey is RRWOHAJPXCZQDX-VOTSOKGWSA-N. The full InChI is InChI=1S/C6H12N2O/c1-6(7)8-2-4-9-5-3-8/h7H,2-5H2,1H3/b7-6+.
What are the key properties of 1-morpholin-4-ylethanimine?
1-morpholin-4-ylethanimine has a molecular weight of 128.18 g/mol, XLogP of 0.32, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-ylethanimine is sourced from PubChem (CID 18727554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).