(Z)-N-methoxy-1-(4-propylphenyl)ethanimine

C12H17NO — CID 90777265

IUPAC(Z)-N-methoxy-1-(4-propylphenyl)ethanimine
SMILESCCCc1ccc(/C(C)=N\OC)cc1
InChIInChI=1S/C12H17NO/c1-4-5-11-6-8-12(9-7-11)10(2)13-14-3/h6-9H,4-5H2,1-3H3/b13-10-
InChIKeyYZQNEFCTTNQDOV-RAXLEYEMSA-N
MW191.27 g/mol
LogP3.01
Rot. Bonds4

About (Z)-N-methoxy-1-(4-propylphenyl)ethanimine

(Z)-N-methoxy-1-(4-propylphenyl)ethanimine (PubChem CID 90777265) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is (Z)-N-methoxy-1-(4-propylphenyl)ethanimine.

Molecular Properties

Compound Name(Z)-N-methoxy-1-(4-propylphenyl)ethanimine
PubChem CID90777265
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name(Z)-N-methoxy-1-(4-propylphenyl)ethanimine
SMILESCCCc1ccc(/C(C)=N\OC)cc1
InChIInChI=1S/C12H17NO/c1-4-5-11-6-8-12(9-7-11)10(2)13-14-3/h6-9H,4-5H2,1-3H3/b13-10-
InChIKeyYZQNEFCTTNQDOV-RAXLEYEMSA-N
XLogP3.01
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 53.01
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

(Z)-1-(4-butylphenyl)-N-methoxyethanimine
CID 90777266
1-[4-[(E)-N-methoxy-C-methylcarbonimidoyl]phenyl]propan-1-one
CID 23555802
methyl N-[1-(4-propylphenyl)ethylideneamino]carbamate
CID 5002814
[4-(N-methoxy-C-methylcarbonimidoyl)phenyl]methyl 2-bromoacetate
CID 173355646
N,N'-bis[1-(4-propylphenyl)ethylideneamino]butanediamide
CID 4173019
2-methyl-1-(4-propylphenyl)prop-1-en-1-amine
CID 170745986
4-[1-(4-propylphenyl)ethylideneamino]benzonitrile
CID 71370540
1-(4-ethylphenyl)-1-N,2-N-dimethoxypropane-1,2-diimine
CID 59967575
2,2-dimethoxy-1-(4-propylphenyl)ethanone
CID 79493319
methyl 4-[4-(4-propylphenyl)phenyl]benzoate
CID 142331537
1-prop-1-en-2-yl-4-[(4-propylphenyl)methyl]benzene
CID 153374408
(E)-1-(3,4-dimethylphenyl)-N-methoxyethanimine
CID 21345733

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methoxy-1-(4-propylphenyl)ethanimine?
The IUPAC name of (Z)-N-methoxy-1-(4-propylphenyl)ethanimine (CID 90777265) is (Z)-N-methoxy-1-(4-propylphenyl)ethanimine.
What is the SMILES notation for (Z)-N-methoxy-1-(4-propylphenyl)ethanimine?
The canonical SMILES for (Z)-N-methoxy-1-(4-propylphenyl)ethanimine is CCCc1ccc(/C(C)=N\OC)cc1.
What is the InChIKey of (Z)-N-methoxy-1-(4-propylphenyl)ethanimine?
The InChIKey is YZQNEFCTTNQDOV-RAXLEYEMSA-N. The full InChI is InChI=1S/C12H17NO/c1-4-5-11-6-8-12(9-7-11)10(2)13-14-3/h6-9H,4-5H2,1-3H3/b13-10-.
What are the key properties of (Z)-N-methoxy-1-(4-propylphenyl)ethanimine?
(Z)-N-methoxy-1-(4-propylphenyl)ethanimine has a molecular weight of 191.27 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methoxy-1-(4-propylphenyl)ethanimine is sourced from PubChem (CID 90777265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).