(E)-N-methoxy-1-(3-methoxyphenyl)ethanimine

C10H13NO2 — CID 11041295

IUPAC(E)-N-methoxy-1-(3-methoxyphenyl)ethanimine
SMILESCO/N=C(\C)c1cccc(OC)c1
InChIInChI=1S/C10H13NO2/c1-8(11-13-3)9-5-4-6-10(7-9)12-2/h4-7H,1-3H3/b11-8+
InChIKeyNNRMQNSLHHZJHJ-DHZHZOJOSA-N
MW179.22 g/mol
LogP2.07
Rot. Bonds3

About (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine

(E)-N-methoxy-1-(3-methoxyphenyl)ethanimine (PubChem CID 11041295) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine.

Molecular Properties

Compound Name(E)-N-methoxy-1-(3-methoxyphenyl)ethanimine
PubChem CID11041295
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name(E)-N-methoxy-1-(3-methoxyphenyl)ethanimine
SMILESCO/N=C(\C)c1cccc(OC)c1
InChIInChI=1S/C10H13NO2/c1-8(11-13-3)9-5-4-6-10(7-9)12-2/h4-7H,1-3H3/b11-8+
InChIKeyNNRMQNSLHHZJHJ-DHZHZOJOSA-N
XLogP2.07
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

(3-Methoxyphenyl)acetonitrile
CID 88310
4-Methoxybenzaldehyde Oxime
CID 5371961
2-Methoxybenzaldehyde oxime
CID 6861468
2-(4-Hydroxyiminocyclohexa-2,5-dien-1-ylidene)-2-(4-methoxyphenyl)acetonitrile
CID 346838
1-(3-Methoxyphenyl)ethanone [1-(3-methoxyphenyl)ethylidene]hydrazone
CID 5331696
Ethanone, 1-(3,4-dimethoxyphenyl)-, oxime, (Z)-
CID 5709027
p-Anisaldehyde, oxime, (Z)-
CID 5371924
Phosphonic acid, (4,5-dihydro-3-(4-methoxyphenyl)-5-isoxazolyl)-
CID 3079438
N-[1-(4-methoxyphenyl)ethylidene]hydroxylamine
CID 5397262
1-Ethyl-3-methoxybenzene
CID 66353
3-Methoxy-benzaldehyde oxime
CID 9601243
4-Methoxybenzaldoxime
CID 94712

Frequently Asked Questions

What is the IUPAC name of (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine?
The IUPAC name of (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine (CID 11041295) is (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine.
What is the SMILES notation for (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine?
The canonical SMILES for (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine is CO/N=C(\C)c1cccc(OC)c1.
What is the InChIKey of (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine?
The InChIKey is NNRMQNSLHHZJHJ-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H13NO2/c1-8(11-13-3)9-5-4-6-10(7-9)12-2/h4-7H,1-3H3/b11-8+.
What are the key properties of (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine?
(E)-N-methoxy-1-(3-methoxyphenyl)ethanimine has a molecular weight of 179.22 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methoxy-1-(3-methoxyphenyl)ethanimine is sourced from PubChem (CID 11041295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).