2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide

C14H11FN2O4 — CID 2885825

IUPAC2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide
SMILESCOc1cc([N+](=O)[O-])ccc1NC(=O)c1ccccc1F
InChIInChI=1S/C14H11FN2O4/c1-21-13-8-9(17(19)20)6-7-12(13)16-14(18)10-4-2-3-5-11(10)15/h2-8H,1H3,(H,16,18)
InChIKeyCWOYYVMUFIIPOE-UHFFFAOYSA-N
MW290.25 g/mol
LogP2.99
Rot. Bonds4

About 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide

2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide (PubChem CID 2885825) has the molecular formula C14H11FN2O4 and a molecular weight of 290.25 g/mol. Its IUPAC name is 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide
PubChem CID2885825
Molecular FormulaC14H11FN2O4
Molecular Weight290.25 g/mol
Exact Mass290.07
IUPAC Name2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide
SMILESCOc1cc([N+](=O)[O-])ccc1NC(=O)c1ccccc1F
InChIInChI=1S/C14H11FN2O4/c1-21-13-8-9(17(19)20)6-7-12(13)16-14(18)10-4-2-3-5-11(10)15/h2-8H,1H3,(H,16,18)
InChIKeyCWOYYVMUFIIPOE-UHFFFAOYSA-N
XLogP2.99
TPSA81.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.25
LogP ≤ 52.99
H-Bond Donors ≤ 51
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'}

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Related Compounds

[(2R)-1-(2-methoxy-4-nitroanilino)-1-oxopropan-2-yl] 2-fluorobenzoate
CID 7864213
2,6-dimethoxy-N-(2-methoxy-4-nitrophenyl)benzamide
CID 4285710
1-N,3-N-bis(2-methoxy-4-nitrophenyl)benzene-1,3-dicarboxamide
CID 4588723
2-[(4-chlorophenyl)sulfonylamino]-N-(2-methoxy-4-nitrophenyl)benzamide
CID 18575745
4-benzamido-N-(2-methoxy-4-nitrophenyl)benzamide
CID 17153277
N-(5-chloro-2,4-dimethoxyphenyl)-2-fluorobenzamide
CID 836294
N-[4-[4-[(2,4-dinitrobenzoyl)amino]-3-methoxyphenyl]-2-methoxyphenyl]-2,4-dinitrobenzamide
CID 3643668
2-bromo-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]benzamide
CID 2897203
2-bromo-N-(2-methoxyphenyl)-5-nitrobenzamide
CID 1371919
propyl 2-[(2-fluorobenzoyl)amino]-4-nitrobenzoate
CID 44577041
4-bromo-N-(2-methoxy-4-nitrophenyl)benzamide
CID 5234028
1-(2-fluorophenyl)-N-(2-methoxy-4-nitrophenyl)piperidine-4-carboxamide
CID 17152713

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide?
The IUPAC name of 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide (CID 2885825) is 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide?
The canonical SMILES for 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide is COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide?
The InChIKey is CWOYYVMUFIIPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O4/c1-21-13-8-9(17(19)20)6-7-12(13)16-14(18)10-4-2-3-5-11(10)15/h2-8H,1H3,(H,16,18).
What are the key properties of 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide?
2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide has a molecular weight of 290.25 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(2-methoxy-4-nitrophenyl)benzamide is sourced from PubChem (CID 2885825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).