1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine

C12H16N2O2 — CID 869581

IUPAC1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine
SMILESCOc1ccc(C=NN2CCOCC2)cc1
InChIInChI=1S/C12H16N2O2/c1-15-12-4-2-11(3-5-12)10-13-14-6-8-16-9-7-14/h2-5,10H,6-9H2,1H3
InChIKeyKLMQXJSKEKLRTG-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.36
Rot. Bonds3

About 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine

1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine (PubChem CID 869581) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine
PubChem CID869581
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine
SMILESCOc1ccc(C=NN2CCOCC2)cc1
InChIInChI=1S/C12H16N2O2/c1-15-12-4-2-11(3-5-12)10-13-14-6-8-16-9-7-14/h2-5,10H,6-9H2,1H3
InChIKeyKLMQXJSKEKLRTG-UHFFFAOYSA-N
XLogP1.36
TPSA34.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine?
The IUPAC name of 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine (CID 869581) is 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine is COc1ccc(C=NN2CCOCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine?
The InChIKey is KLMQXJSKEKLRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-15-12-4-2-11(3-5-12)10-13-14-6-8-16-9-7-14/h2-5,10H,6-9H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine?
1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine has a molecular weight of 220.27 g/mol, XLogP of 1.36, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-morpholin-4-ylmethanimine is sourced from PubChem (CID 869581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).