2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide

C15H14N2O4 — CID 24873981

IUPAC2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide
SMILESO=C(Cc1ccccc1O)NCc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C15H14N2O4/c18-14-8-4-2-5-11(14)9-15(19)16-10-12-6-1-3-7-13(12)17(20)21/h1-8,18H,9-10H2,(H,16,19)
InChIKeyNNWBSHSQNQRQFE-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.16
Rot. Bonds5

About 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide

2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide (PubChem CID 24873981) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide
PubChem CID24873981
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide
SMILESO=C(Cc1ccccc1O)NCc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C15H14N2O4/c18-14-8-4-2-5-11(14)9-15(19)16-10-12-6-1-3-7-13(12)17(20)21/h1-8,18H,9-10H2,(H,16,19)
InChIKeyNNWBSHSQNQRQFE-UHFFFAOYSA-N
XLogP2.16
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-nitrophenyl)methylcarbamic acid
CID 18621803
N-[[2-(methoxymethyl)phenyl]methyl]-2-(2-nitrophenyl)acetamide
CID 32602817
4-amino-N-[(2-nitrophenyl)methyl]butanamide;hydrochloride
CID 119280318
N-[(2-nitrophenyl)methyl]-2-propan-2-yloxyacetamide
CID 47413238
N-[(4-aminophenyl)methyl]-2-(2-nitrophenyl)acetamide
CID 116649980
2-(3-methoxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide
CID 87004950
2-[(2-nitrophenyl)methyl]phenol
CID 22062598
2-[[2-(2-nitrophenyl)ethylamino]methyl]phenol
CID 115656030
(2R)-2-amino-N-[(2-nitrophenyl)methyl]propanamide
CID 78979257
2-hydroxy-N-[(2-hydroxy-3-nitrophenyl)methyl]acetamide
CID 145093020
2-bromo-2-methyl-N-[(2-nitrophenyl)methyl]propanamide
CID 114328572
2-(2-nitrophenyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide
CID 41419267

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide (CID 24873981) is 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide is O=C(Cc1ccccc1O)NCc1ccccc1[N+](=O)[O-].
What is the InChIKey of 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide?
The InChIKey is NNWBSHSQNQRQFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c18-14-8-4-2-5-11(14)9-15(19)16-10-12-6-1-3-7-13(12)17(20)21/h1-8,18H,9-10H2,(H,16,19).
What are the key properties of 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide?
2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide has a molecular weight of 286.29 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide is sourced from PubChem (CID 24873981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).