N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide

C16H16N2O5 — CID 3375188

IUPACN-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccccc2OC)c([N+](=O)[O-])c1
InChIInChI=1S/C16H16N2O5/c1-22-12-7-8-13(14(10-12)18(20)21)17-16(19)9-11-5-3-4-6-15(11)23-2/h3-8,10H,9H2,1-2H3,(H,17,19)
InChIKeyKWTSMEONMIBDGK-UHFFFAOYSA-N
MW316.31 g/mol
LogP2.79
Rot. Bonds6

About N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide

N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide (PubChem CID 3375188) has the molecular formula C16H16N2O5 and a molecular weight of 316.31 g/mol. Its IUPAC name is N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide
PubChem CID3375188
Molecular FormulaC16H16N2O5
Molecular Weight316.31 g/mol
Exact Mass316.11
IUPAC NameN-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccccc2OC)c([N+](=O)[O-])c1
InChIInChI=1S/C16H16N2O5/c1-22-12-7-8-13(14(10-12)18(20)21)17-16(19)9-11-5-3-4-6-15(11)23-2/h3-8,10H,9H2,1-2H3,(H,17,19)
InChIKeyKWTSMEONMIBDGK-UHFFFAOYSA-N
XLogP2.79
TPSA90.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.31
LogP ≤ 52.79
H-Bond Donors ≤ 51
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

N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide
CID 3101369
2-(2-methoxyphenyl)-N-(2-nitrophenyl)acetamide
CID 3253389
2-(2,4-dimethoxyphenyl)-N-(2-nitro-4-propoxyphenyl)acetamide
CID 110493113
N-(4-methoxy-2-nitrophenyl)-2-naphthalen-2-ylacetamide
CID 16849665
2-(2-acetamidophenoxy)-N-(4-methoxy-2-nitrophenyl)acetamide
CID 7867384
N-(2-amino-5-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 63257795
N-(4-methoxy-2-nitrophenyl)-2-nitrosoacetamide
CID 90848222
2-[(4-methoxy-2-nitroanilino)methyl]phenol
CID 43717858
3-[3-(4-methoxy-2-nitroanilino)-3-oxopropyl]sulfanyl-N-(4-methoxy-2-nitrophenyl)propanamide
CID 5142693
3-methoxy-N-(4-methoxy-2-nitrophenyl)naphthalene-2-carboxamide
CID 3539530
N-(4-methoxy-2-nitrophenyl)-3-phenylsulfanylpropanamide
CID 2975810
N,N'-bis(4-methoxy-2-nitrophenyl)-2-phenylpropanediamide
CID 3394012

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide (CID 3375188) is N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cc2ccccc2OC)c([N+](=O)[O-])c1.
What is the InChIKey of N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
The InChIKey is KWTSMEONMIBDGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O5/c1-22-12-7-8-13(14(10-12)18(20)21)17-16(19)9-11-5-3-4-6-15(11)23-2/h3-8,10H,9H2,1-2H3,(H,17,19).
What are the key properties of N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide has a molecular weight of 316.31 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 3375188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).