N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide

C10H14N2O3 — CID 24696313

IUPACN'-hydroxy-3-(2-methoxyphenoxy)propanimidamide
SMILESCOc1ccccc1OCC/C(N)=N/O
InChIInChI=1S/C10H14N2O3/c1-14-8-4-2-3-5-9(8)15-7-6-10(11)12-13/h2-5,13H,6-7H2,1H3,(H2,11,12)
InChIKeyKZORBKUQLROAHZ-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.21
Rot. Bonds5

About N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide

N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide (PubChem CID 24696313) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide.

Molecular Properties

Compound NameN'-hydroxy-3-(2-methoxyphenoxy)propanimidamide
PubChem CID24696313
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC NameN'-hydroxy-3-(2-methoxyphenoxy)propanimidamide
SMILESCOc1ccccc1OCC/C(N)=N/O
InChIInChI=1S/C10H14N2O3/c1-14-8-4-2-3-5-9(8)15-7-6-10(11)12-13/h2-5,13H,6-7H2,1H3,(H2,11,12)
InChIKeyKZORBKUQLROAHZ-UHFFFAOYSA-N
XLogP1.21
TPSA77.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.21
H-Bond Donors ≤ 52
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

N'-hydroxy-3-[4-(hydroxymethyl)-2-methoxyphenoxy]propanimidamide
CID 107743240
3-(2-methoxyphenoxy)propanimidamide
CID 24698290
3-(2-bromo-4-methoxyphenoxy)-N'-hydroxypropanimidamide
CID 104707785
N'-hydroxy-4-(2-propan-2-ylphenoxy)butanimidamide
CID 24689545
3-(2-methoxyphenoxy)propanoyl chloride
CID 82040752
1-methoxy-2-[12-(2-methoxyphenoxy)dodecoxy]benzene
CID 134880850
3-(2,5-difluorophenoxy)-N'-hydroxypropanimidamide
CID 76992494
2-(2-methoxyphenoxy)ethyl carbamate
CID 54433856
3-amino-1-[4-[3-(2-methoxyphenoxy)propanoyl]piperazin-1-yl]propan-1-one
CID 4740257
N'-hydroxy-4-(2-phenylphenoxy)butanimidamide
CID 24695153
4-(2-methoxyphenoxy)butan-1-ol
CID 43510003
5-(2,5-dibromo-4-methoxyphenoxy)-N'-hydroxypentanimidamide
CID 79404299

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide?
The IUPAC name of N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide (CID 24696313) is N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide.
What is the SMILES notation for N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide?
The canonical SMILES for N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide is COc1ccccc1OCC/C(N)=N/O.
What is the InChIKey of N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide?
The InChIKey is KZORBKUQLROAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-14-8-4-2-3-5-9(8)15-7-6-10(11)12-13/h2-5,13H,6-7H2,1H3,(H2,11,12).
What are the key properties of N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide?
N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide has a molecular weight of 210.23 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-3-(2-methoxyphenoxy)propanimidamide is sourced from PubChem (CID 24696313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).