(Z)-N-methoxy-1-naphthalen-2-ylmethanimine

C12H11NO — CID 53308536

IUPAC(Z)-N-methoxy-1-naphthalen-2-ylmethanimine
SMILESCO/N=C\c1ccc2ccccc2c1
InChIInChI=1S/C12H11NO/c1-14-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9-
InChIKeyPKUWSXJLJDEWGO-LCYFTJDESA-N
MW185.23 g/mol
LogP2.82
Rot. Bonds2

About (Z)-N-methoxy-1-naphthalen-2-ylmethanimine

(Z)-N-methoxy-1-naphthalen-2-ylmethanimine (PubChem CID 53308536) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is (Z)-N-methoxy-1-naphthalen-2-ylmethanimine.

Molecular Properties

Compound Name(Z)-N-methoxy-1-naphthalen-2-ylmethanimine
PubChem CID53308536
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name(Z)-N-methoxy-1-naphthalen-2-ylmethanimine
SMILESCO/N=C\c1ccc2ccccc2c1
InChIInChI=1S/C12H11NO/c1-14-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9-
InChIKeyPKUWSXJLJDEWGO-LCYFTJDESA-N
XLogP2.82
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.82
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-naphthalen-2-ylmethanimine?
The IUPAC name of (Z)-N-methoxy-1-naphthalen-2-ylmethanimine (CID 53308536) is (Z)-N-methoxy-1-naphthalen-2-ylmethanimine.
What is the SMILES notation for (Z)-N-methoxy-1-naphthalen-2-ylmethanimine?
The canonical SMILES for (Z)-N-methoxy-1-naphthalen-2-ylmethanimine is CO/N=C\c1ccc2ccccc2c1.
What is the InChIKey of (Z)-N-methoxy-1-naphthalen-2-ylmethanimine?
The InChIKey is PKUWSXJLJDEWGO-LCYFTJDESA-N. The full InChI is InChI=1S/C12H11NO/c1-14-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9-.
What are the key properties of (Z)-N-methoxy-1-naphthalen-2-ylmethanimine?
(Z)-N-methoxy-1-naphthalen-2-ylmethanimine has a molecular weight of 185.23 g/mol, XLogP of 2.82, 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-naphthalen-2-ylmethanimine is sourced from PubChem (CID 53308536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).