1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine

C12H23N3O — CID 114400417

IUPAC1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine
SMILES[H]/N=C1\CCCCN1CC1CN(CC)CCO1
InChIInChI=1S/C12H23N3O/c1-2-14-7-8-16-11(9-14)10-15-6-4-3-5-12(15)13/h11,13H,2-10H2,1H3/b13-12+
InChIKeyUKZDDPKZIUZXTI-OUKQBFOZSA-N
MW225.34 g/mol
LogP1.17
Rot. Bonds3

About 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine

1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine (PubChem CID 114400417) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine.

Molecular Properties

Compound Name1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine
PubChem CID114400417
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine
SMILES[H]/N=C1\CCCCN1CC1CN(CC)CCO1
InChIInChI=1S/C12H23N3O/c1-2-14-7-8-16-11(9-14)10-15-6-4-3-5-12(15)13/h11,13H,2-10H2,1H3/b13-12+
InChIKeyUKZDDPKZIUZXTI-OUKQBFOZSA-N
XLogP1.17
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[(1-ethylpyrrolidin-3-yl)methyl]pyrrolidin-2-imine
CID 60856218
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carboximidamide
CID 79171844
2,4-diethylmorpholine
CID 58988021
1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine
CID 114456230
4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 114401064
1-[(4-ethylmorpholin-2-yl)methyl]pyrrole-2,5-dione
CID 114400408
1-(1,3-dithiolan-2-ylmethyl)piperidin-2-imine
CID 164660868
4-ethyl-2-propylmorpholine
CID 127673597
2-(4-ethylmorpholin-2-yl)acetonitrile
CID 79164435
1-[(4-ethylmorpholin-2-yl)methyl]-3,4-dihydro-2H-quinolin-3-amine
CID 79182791
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepan-2-imine
CID 67572582
1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 79171854

Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine?
The IUPAC name of 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine (CID 114400417) is 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine.
What is the SMILES notation for 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine?
The canonical SMILES for 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine is [H]/N=C1\CCCCN1CC1CN(CC)CCO1.
What is the InChIKey of 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine?
The InChIKey is UKZDDPKZIUZXTI-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H23N3O/c1-2-14-7-8-16-11(9-14)10-15-6-4-3-5-12(15)13/h11,13H,2-10H2,1H3/b13-12+.
What are the key properties of 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine?
1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine has a molecular weight of 225.34 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine is sourced from PubChem (CID 114400417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).