2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide

C10H14N2O3 — CID 59395610

IUPAC2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide
SMILESCCOc1cc(C/C(N)=N/O)ccc1O
InChIInChI=1S/C10H14N2O3/c1-2-15-9-5-7(3-4-8(9)13)6-10(11)12-14/h3-5,13-14H,2,6H2,1H3,(H2,11,12)
InChIKeyGDLPNUZYSAZFSB-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.08
Rot. Bonds4

About 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide

2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide (PubChem CID 59395610) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide
PubChem CID59395610
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide
SMILESCCOc1cc(C/C(N)=N/O)ccc1O
InChIInChI=1S/C10H14N2O3/c1-2-15-9-5-7(3-4-8(9)13)6-10(11)12-14/h3-5,13-14H,2,6H2,1H3,(H2,11,12)
InChIKeyGDLPNUZYSAZFSB-UHFFFAOYSA-N
XLogP1.08
TPSA88.07 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(3-ethoxy-4-hydroxyphenyl)ethanimidamide
CID 91756255
1-(3-ethoxy-4-hydroxyphenyl)butan-2-one
CID 154133962
3-(3-ethoxy-4-hydroxyphenyl)-2-oxopropanoic acid
CID 16781603
2-(3-ethoxy-4-hydroxyphenyl)acetaldehyde
CID 54156927
2-ethoxy-4-(methylaminomethyl)phenol
CID 16776359
4-amino-2-ethoxyphenol
CID 12856010
4-[(3S)-3-aminobutyl]-2-ethoxyphenol
CID 94920449
4-[[bis(2-methylpropyl)amino]methyl]-2-ethoxyphenol
CID 82982111
4-(3-ethoxy-4-hydroxyphenyl)butan-2-one
CID 45094126
4-[2-amino-2-(dimethylamino)propyl]-2-ethoxyphenol
CID 84748173
2-[(3-ethoxy-4-hydroxyphenyl)methyl]-1-(4-methylphenyl)guanidine
CID 111101219
4-[(2E)-2-hydroxyiminopropyl]-2-methoxyphenol
CID 11321502

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide?
The IUPAC name of 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide (CID 59395610) is 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide?
The canonical SMILES for 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide is CCOc1cc(C/C(N)=N/O)ccc1O.
What is the InChIKey of 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide?
The InChIKey is GDLPNUZYSAZFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-2-15-9-5-7(3-4-8(9)13)6-10(11)12-14/h3-5,13-14H,2,6H2,1H3,(H2,11,12).
What are the key properties of 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide?
2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide has a molecular weight of 210.23 g/mol, XLogP of 1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxy-4-hydroxyphenyl)-N'-hydroxyethanimidamide is sourced from PubChem (CID 59395610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).