(Z)-N-methoxy-1-phenylethanimine

C9H11NO — CID 6369935

IUPAC(Z)-N-methoxy-1-phenylethanimine
SMILESCO/N=C(/C)c1ccccc1
InChIInChI=1S/C9H11NO/c1-8(10-11-2)9-6-4-3-5-7-9/h3-7H,1-2H3/b10-8-
InChIKeyFRRKMGKUCIICOM-NTMALXAHSA-N
MW149.19 g/mol
LogP2.06
Rot. Bonds2

About (Z)-N-methoxy-1-phenylethanimine

(Z)-N-methoxy-1-phenylethanimine (PubChem CID 6369935) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is (Z)-N-methoxy-1-phenylethanimine.

Molecular Properties

Compound Name(Z)-N-methoxy-1-phenylethanimine
PubChem CID6369935
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name(Z)-N-methoxy-1-phenylethanimine
SMILESCO/N=C(/C)c1ccccc1
InChIInChI=1S/C9H11NO/c1-8(10-11-2)9-6-4-3-5-7-9/h3-7H,1-2H3/b10-8-
InChIKeyFRRKMGKUCIICOM-NTMALXAHSA-N
XLogP2.06
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-methoxy-1-phenylethanimine?
The IUPAC name of (Z)-N-methoxy-1-phenylethanimine (CID 6369935) is (Z)-N-methoxy-1-phenylethanimine.
What is the SMILES notation for (Z)-N-methoxy-1-phenylethanimine?
The canonical SMILES for (Z)-N-methoxy-1-phenylethanimine is CO/N=C(/C)c1ccccc1.
What is the InChIKey of (Z)-N-methoxy-1-phenylethanimine?
The InChIKey is FRRKMGKUCIICOM-NTMALXAHSA-N. The full InChI is InChI=1S/C9H11NO/c1-8(10-11-2)9-6-4-3-5-7-9/h3-7H,1-2H3/b10-8-.
What are the key properties of (Z)-N-methoxy-1-phenylethanimine?
(Z)-N-methoxy-1-phenylethanimine has a molecular weight of 149.19 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methoxy-1-phenylethanimine is sourced from PubChem (CID 6369935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).