N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide

C10H10N2O3 — CID 88893373

IUPACN-(3-formyl-4-methyl-2-nitrosophenyl)acetamide
SMILESCC(=O)Nc1ccc(C)c(C=O)c1N=O
InChIInChI=1S/C10H10N2O3/c1-6-3-4-9(11-7(2)14)10(12-15)8(6)5-13/h3-5H,1-2H3,(H,11,14)
InChIKeyDZYRKCDLKVPEDJ-UHFFFAOYSA-N
MW206.20 g/mol
LogP2.16
Rot. Bonds3

About N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide

N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide (PubChem CID 88893373) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide.

Molecular Properties

Compound NameN-(3-formyl-4-methyl-2-nitrosophenyl)acetamide
PubChem CID88893373
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC NameN-(3-formyl-4-methyl-2-nitrosophenyl)acetamide
SMILESCC(=O)Nc1ccc(C)c(C=O)c1N=O
InChIInChI=1S/C10H10N2O3/c1-6-3-4-9(11-7(2)14)10(12-15)8(6)5-13/h3-5H,1-2H3,(H,11,14)
InChIKeyDZYRKCDLKVPEDJ-UHFFFAOYSA-N
XLogP2.16
TPSA75.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide?
The IUPAC name of N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide (CID 88893373) is N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide.
What is the SMILES notation for N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide?
The canonical SMILES for N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide is CC(=O)Nc1ccc(C)c(C=O)c1N=O.
What is the InChIKey of N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide?
The InChIKey is DZYRKCDLKVPEDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c1-6-3-4-9(11-7(2)14)10(12-15)8(6)5-13/h3-5H,1-2H3,(H,11,14).
What are the key properties of N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide?
N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide has a molecular weight of 206.20 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide is sourced from PubChem (CID 88893373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).