(Z)-N-[(4-chlorophenyl)methoxy]ethanimine

C9H10ClNO — CID 97307953

IUPAC(Z)-N-[(4-chlorophenyl)methoxy]ethanimine
SMILESC/C=N\OCc1ccc(Cl)cc1
InChIInChI=1S/C9H10ClNO/c1-2-11-12-7-8-3-5-9(10)6-4-8/h2-6H,7H2,1H3/b11-2-
InChIKeyRNQWPFCMVULLMA-FUQNDXKWSA-N
MW183.64 g/mol
LogP2.86
Rot. Bonds3

About (Z)-N-[(4-chlorophenyl)methoxy]ethanimine

(Z)-N-[(4-chlorophenyl)methoxy]ethanimine (PubChem CID 97307953) has the molecular formula C9H10ClNO and a molecular weight of 183.64 g/mol. Its IUPAC name is (Z)-N-[(4-chlorophenyl)methoxy]ethanimine.

Molecular Properties

Compound Name(Z)-N-[(4-chlorophenyl)methoxy]ethanimine
PubChem CID97307953
Molecular FormulaC9H10ClNO
Molecular Weight183.64 g/mol
Exact Mass183.05
IUPAC Name(Z)-N-[(4-chlorophenyl)methoxy]ethanimine
SMILESC/C=N\OCc1ccc(Cl)cc1
InChIInChI=1S/C9H10ClNO/c1-2-11-12-7-8-3-5-9(10)6-4-8/h2-6H,7H2,1H3/b11-2-
InChIKeyRNQWPFCMVULLMA-FUQNDXKWSA-N
XLogP2.86
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 52.86
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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Related Compounds

(E)-N-[(3,4-difluorophenyl)methoxy]ethanimine
CID 59571779
(E)-N-[(4-chlorophenyl)methoxy]-2-methylpropan-1-imine
CID 118480607
(E)-N-[(4-chlorophenyl)methoxy]-1-phenylmethanimine
CID 117060747
N-[(4-bromophenyl)methoxy]-1-(4-chlorophenyl)methanimine
CID 73380524
N-[(4-chlorophenyl)methoxy]-1-thiophen-2-ylmethanimine
CID 2803585
(E)-N-[(4-chlorophenyl)methoxy]-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methanimine
CID 10707121
(2R,3E)-1-(tert-butylamino)-3-[(4-chlorophenyl)methoxyimino]propan-2-ol
CID 10401649
(Z)-1-(3-chloro-4,5-dimethoxyphenyl)-N-[(4-chlorophenyl)methoxy]methanimine
CID 7702644
N-[(4-chlorophenyl)methoxy]piperidin-4-imine
CID 21259128
1-[(4-chlorophenyl)methoxy]ethanol
CID 134444684
1-(4-chlorophenyl)-N-[(3-fluoro-4-methoxyphenyl)methoxy]methanimine
CID 78766572
1-(4-chlorophenyl)-N-[(3-chlorophenyl)methoxy]methanimine
CID 76856286

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(4-chlorophenyl)methoxy]ethanimine?
The IUPAC name of (Z)-N-[(4-chlorophenyl)methoxy]ethanimine (CID 97307953) is (Z)-N-[(4-chlorophenyl)methoxy]ethanimine.
What is the SMILES notation for (Z)-N-[(4-chlorophenyl)methoxy]ethanimine?
The canonical SMILES for (Z)-N-[(4-chlorophenyl)methoxy]ethanimine is C/C=N\OCc1ccc(Cl)cc1.
What is the InChIKey of (Z)-N-[(4-chlorophenyl)methoxy]ethanimine?
The InChIKey is RNQWPFCMVULLMA-FUQNDXKWSA-N. The full InChI is InChI=1S/C9H10ClNO/c1-2-11-12-7-8-3-5-9(10)6-4-8/h2-6H,7H2,1H3/b11-2-.
What are the key properties of (Z)-N-[(4-chlorophenyl)methoxy]ethanimine?
(Z)-N-[(4-chlorophenyl)methoxy]ethanimine has a molecular weight of 183.64 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(4-chlorophenyl)methoxy]ethanimine is sourced from PubChem (CID 97307953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).