3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine

C19H29N3O2 — CID 15746235

IUPAC3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine
SMILESCOCCC1CCCN(C)/C1=N/c1ccccc1N1CCOCC1
InChIInChI=1S/C19H29N3O2/c1-21-10-5-6-16(9-13-23-2)19(21)20-17-7-3-4-8-18(17)22-11-14-24-15-12-22/h3-4,7-8,16H,5-6,9-15H2,1-2H3/b20-19+
InChIKeyAQZNKAOPGCQVQS-FMQUCBEESA-N
MW331.46 g/mol
LogP2.93
Rot. Bonds5

About 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine

3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine (PubChem CID 15746235) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine.

Molecular Properties

Compound Name3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine
PubChem CID15746235
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine
SMILESCOCCC1CCCN(C)/C1=N/c1ccccc1N1CCOCC1
InChIInChI=1S/C19H29N3O2/c1-21-10-5-6-16(9-13-23-2)19(21)20-17-7-3-4-8-18(17)22-11-14-24-15-12-22/h3-4,7-8,16H,5-6,9-15H2,1-2H3/b20-19+
InChIKeyAQZNKAOPGCQVQS-FMQUCBEESA-N
XLogP2.93
TPSA37.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-N-(2-morpholin-4-ylphenyl)pyrrolidin-2-imine
CID 15746242
1,3-dimethyl-N-(2-pyrrolidin-1-ylphenyl)piperidin-2-imine
CID 139692559
16-(2-methoxyphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 86134682
4-(2-chloro-3-methoxyphenyl)morpholine
CID 102440572
N-[(1-methylpiperidin-3-yl)methyl]-2-morpholin-4-ylaniline
CID 62659401
1-methyl-N-(2-morpholin-4-ylphenyl)azepan-4-amine
CID 65070370
4-(2-methoxyethyl)-N-(2-morpholin-4-ylphenyl)piperazine-1-carboxamide
CID 113105000
[3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone
CID 131948357
2-morpholin-4-yl-N-(oxan-4-ylmethyl)aniline
CID 62385049
ethoxy-(2-morpholin-4-ylphenyl)methanol
CID 91211184
1-(2-methoxyethyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
CID 110559521
methylsulfanylmethyl 2-morpholin-4-ylbenzoate
CID 174939418

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine?
The IUPAC name of 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine (CID 15746235) is 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine.
What is the SMILES notation for 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine?
The canonical SMILES for 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine is COCCC1CCCN(C)/C1=N/c1ccccc1N1CCOCC1.
What is the InChIKey of 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine?
The InChIKey is AQZNKAOPGCQVQS-FMQUCBEESA-N. The full InChI is InChI=1S/C19H29N3O2/c1-21-10-5-6-16(9-13-23-2)19(21)20-17-7-3-4-8-18(17)22-11-14-24-15-12-22/h3-4,7-8,16H,5-6,9-15H2,1-2H3/b20-19+.
What are the key properties of 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine?
3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine has a molecular weight of 331.46 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-1-methyl-N-(2-morpholin-4-ylphenyl)piperidin-2-imine is sourced from PubChem (CID 15746235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).