N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide

C10H12N2O5 — CID 55027939

IUPACN-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide
SMILESCON(C)C(=O)COc1cccc([N+](=O)[O-])c1
InChIInChI=1S/C10H12N2O5/c1-11(16-2)10(13)7-17-9-5-3-4-8(6-9)12(14)15/h3-6H,7H2,1-2H3
InChIKeyHMUQDXOXFHYRAE-UHFFFAOYSA-N
MW240.22 g/mol
LogP0.99
Rot. Bonds5

About N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide

N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide (PubChem CID 55027939) has the molecular formula C10H12N2O5 and a molecular weight of 240.22 g/mol. Its IUPAC name is N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide
PubChem CID55027939
Molecular FormulaC10H12N2O5
Molecular Weight240.22 g/mol
Exact Mass240.07
IUPAC NameN-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide
SMILESCON(C)C(=O)COc1cccc([N+](=O)[O-])c1
InChIInChI=1S/C10H12N2O5/c1-11(16-2)10(13)7-17-9-5-3-4-8(6-9)12(14)15/h3-6H,7H2,1-2H3
InChIKeyHMUQDXOXFHYRAE-UHFFFAOYSA-N
XLogP0.99
TPSA81.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-methoxy-3-(3-nitrophenoxy)propan-2-one
CID 107508001
N-methyl-2-[methyl-[2-(3-nitrophenoxy)acetyl]amino]acetamide
CID 8586850
2-[2-methoxyethyl-[2-(3-nitrophenoxy)acetyl]amino]acetic acid
CID 119188944
N,N-bis(2-cyanoethyl)-2-(3-nitrophenoxy)acetamide
CID 32698814
N-[(4-bromophenyl)methyl]-N-methyl-2-(3-nitrophenoxy)acetamide
CID 30381222
N-tert-butyl-2-[methyl-[2-(3-nitrophenoxy)acetyl]amino]acetamide
CID 8586964
N-methyl-2-(3-nitrophenoxy)-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 64511055
4-(3-nitrophenoxy)butan-2-one
CID 60693072
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-(3-nitrophenoxy)acetamide
CID 63929130
2-[ethyl-[2-(3-nitrophenoxy)acetyl]amino]-N-propan-2-ylacetamide
CID 32711134
1-(2,6-difluorophenyl)-2-(3-nitrophenoxy)ethanone
CID 60662380
2-(3-nitrophenoxy)-1-(1H-pyrrol-2-yl)ethanone
CID 27015921

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide?
The IUPAC name of N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide (CID 55027939) is N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide.
What is the SMILES notation for N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide?
The canonical SMILES for N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide is CON(C)C(=O)COc1cccc([N+](=O)[O-])c1.
What is the InChIKey of N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide?
The InChIKey is HMUQDXOXFHYRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O5/c1-11(16-2)10(13)7-17-9-5-3-4-8(6-9)12(14)15/h3-6H,7H2,1-2H3.
What are the key properties of N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide?
N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide has a molecular weight of 240.22 g/mol, XLogP of 0.99, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-2-(3-nitrophenoxy)acetamide is sourced from PubChem (CID 55027939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).