2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide

C10H12N2O3 — CID 24699457

IUPAC2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide
SMILESC/C(=N\O)c1ccccc1OCC(N)=O
InChIInChI=1S/C10H12N2O3/c1-7(12-14)8-4-2-3-5-9(8)15-6-10(11)13/h2-5,14H,6H2,1H3,(H2,11,13)/b12-7+
InChIKeyQUYXLTSEFCKRMS-KPKJPENVSA-N
MW208.22 g/mol
LogP0.75
Rot. Bonds4

About 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide

2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide (PubChem CID 24699457) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide
PubChem CID24699457
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide
SMILESC/C(=N\O)c1ccccc1OCC(N)=O
InChIInChI=1S/C10H12N2O3/c1-7(12-14)8-4-2-3-5-9(8)15-6-10(11)13/h2-5,14H,6H2,1H3,(H2,11,13)/b12-7+
InChIKeyQUYXLTSEFCKRMS-KPKJPENVSA-N
XLogP0.75
TPSA84.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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-[(Z)-1-[2-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]pyridine-4-carboxamide
CID 6302652
2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 24694563
2-(2-amino-2-oxoethoxy)benzamide;ethanesulfonic acid
CID 172768099
(NE)-N-[1-[2-(2,2-difluoroethoxy)phenyl]ethylidene]hydroxylamine
CID 60922167
1-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]propan-2-ol
CID 60885810
N-[(E)-1-[2-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]-2-methylfuran-3-carboxamide
CID 5455528
N-[1-[2-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]pyridine-3-carboxamide
CID 842406
2-(2-hydroxyphenoxy)acetamide
CID 786426
N-[1-(2-decoxyphenyl)ethylidene]hydroxylamine
CID 76999545
(NE)-N-[1-(2-octoxyphenyl)ethylidene]hydroxylamine
CID 43129538
N-[1-[2-(2-phenylsulfanylethoxy)phenyl]ethylidene]hydroxylamine
CID 79221819
N-(4-acetylphenyl)-2-(2-amino-2-oxoethoxy)benzamide
CID 34795429

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide?
The IUPAC name of 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide (CID 24699457) is 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide?
The canonical SMILES for 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide is C/C(=N\O)c1ccccc1OCC(N)=O.
What is the InChIKey of 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide?
The InChIKey is QUYXLTSEFCKRMS-KPKJPENVSA-N. The full InChI is InChI=1S/C10H12N2O3/c1-7(12-14)8-4-2-3-5-9(8)15-6-10(11)13/h2-5,14H,6H2,1H3,(H2,11,13)/b12-7+.
What are the key properties of 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide?
2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide has a molecular weight of 208.22 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide is sourced from PubChem (CID 24699457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).