N-(3-iodophenyl)-3-(methoxymethyl)benzamide

C15H14INO2 — CID 7603133

IUPACN-(3-iodophenyl)-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)Nc2cccc(I)c2)c1
InChIInChI=1S/C15H14INO2/c1-19-10-11-4-2-5-12(8-11)15(18)17-14-7-3-6-13(16)9-14/h2-9H,10H2,1H3,(H,17,18)
InChIKeyMJTUAKHKUVDHJE-UHFFFAOYSA-N
MW367.19 g/mol
LogP3.69
Rot. Bonds4

About N-(3-iodophenyl)-3-(methoxymethyl)benzamide

N-(3-iodophenyl)-3-(methoxymethyl)benzamide (PubChem CID 7603133) has the molecular formula C15H14INO2 and a molecular weight of 367.19 g/mol. Its IUPAC name is N-(3-iodophenyl)-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-(3-iodophenyl)-3-(methoxymethyl)benzamide
PubChem CID7603133
Molecular FormulaC15H14INO2
Molecular Weight367.19 g/mol
Exact Mass367.01
IUPAC NameN-(3-iodophenyl)-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)Nc2cccc(I)c2)c1
InChIInChI=1S/C15H14INO2/c1-19-10-11-4-2-5-12(8-11)15(18)17-14-7-3-6-13(16)9-14/h2-9H,10H2,1H3,(H,17,18)
InChIKeyMJTUAKHKUVDHJE-UHFFFAOYSA-N
XLogP3.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.19
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17471157
N-(3-fluorophenyl)-3-(methoxymethyl)benzamide
CID 17462584
4-benzamido-N-[3-(methoxymethyl)phenyl]benzamide
CID 32639408
N-(3-ethylphenyl)-3-iodobenzamide
CID 2591482
N-[3-(methoxymethyl)phenyl]-3-methylsulfonylbenzamide
CID 33099883
4-fluoro-N-[3-(methoxymethyl)phenyl]-3-methylbenzamide
CID 63213049
N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide
CID 8777307
N-[3-(methoxymethyl)phenyl]pyridine-3-carboxamide
CID 32638262
2-iodo-N-[3-(methoxymethyl)phenyl]benzamide
CID 1313720
4-hydrazinyl-N-[3-(methoxymethyl)phenyl]benzamide
CID 62247351
ethyl 4-[[3-(methoxymethyl)benzoyl]amino]benzoate
CID 51200273
2-[3-[(3-iodobenzoyl)amino]phenyl]acetic acid
CID 65346308

Frequently Asked Questions

What is the IUPAC name of N-(3-iodophenyl)-3-(methoxymethyl)benzamide?
The IUPAC name of N-(3-iodophenyl)-3-(methoxymethyl)benzamide (CID 7603133) is N-(3-iodophenyl)-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-(3-iodophenyl)-3-(methoxymethyl)benzamide?
The canonical SMILES for N-(3-iodophenyl)-3-(methoxymethyl)benzamide is COCc1cccc(C(=O)Nc2cccc(I)c2)c1.
What is the InChIKey of N-(3-iodophenyl)-3-(methoxymethyl)benzamide?
The InChIKey is MJTUAKHKUVDHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14INO2/c1-19-10-11-4-2-5-12(8-11)15(18)17-14-7-3-6-13(16)9-14/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of N-(3-iodophenyl)-3-(methoxymethyl)benzamide?
N-(3-iodophenyl)-3-(methoxymethyl)benzamide has a molecular weight of 367.19 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-iodophenyl)-3-(methoxymethyl)benzamide is sourced from PubChem (CID 7603133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).