N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide

C16H16INO — CID 17274184

IUPACN-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc(C)c(I)c(C)c1
InChIInChI=1S/C16H16INO/c1-10-6-4-5-7-14(10)16(19)18-13-8-11(2)15(17)12(3)9-13/h4-9H,1-3H3,(H,18,19)
InChIKeyNTQFAHBOOCKQAK-UHFFFAOYSA-N
MW365.21 g/mol
LogP4.47
Rot. Bonds2

About N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide

N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide (PubChem CID 17274184) has the molecular formula C16H16INO and a molecular weight of 365.21 g/mol. Its IUPAC name is N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide
PubChem CID17274184
Molecular FormulaC16H16INO
Molecular Weight365.21 g/mol
Exact Mass365.03
IUPAC NameN-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc(C)c(I)c(C)c1
InChIInChI=1S/C16H16INO/c1-10-6-4-5-7-14(10)16(19)18-13-8-11(2)15(17)12(3)9-13/h4-9H,1-3H3,(H,18,19)
InChIKeyNTQFAHBOOCKQAK-UHFFFAOYSA-N
XLogP4.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.21
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-[3-methyl-4-[2-methyl-4-[(2-methylbenzoyl)amino]phenyl]phenyl]benzamide
CID 23908248
N-(3,5-dimethoxyphenyl)-2-methylbenzamide
CID 9096893
N-[4-hydroxy-3-[(2-methylbenzoyl)amino]phenyl]-2-methylbenzamide
CID 154278124
2-methyl-N-(4-sulfanylphenyl)benzamide
CID 143459352
4-[(2-methylbenzoyl)amino]benzoic acid
CID 11615814
5-methyl-2-[(2-methylbenzoyl)amino]benzoic acid
CID 21232994
N-(3-bromo-5-methylphenyl)-2-iodo-3-methylbenzamide
CID 114030738
N-[3-(2,3-dimethylbenzoyl)phenyl]-2-methylbenzamide
CID 846043
2-methyl-N-[4-(propan-2-ylamino)phenyl]benzamide
CID 112979818
N-(3,4-dimethylphenyl)-2,3-dimethylbenzamide
CID 26593883
N-(2-bromo-4,5-dimethylphenyl)-2-methylbenzamide
CID 1233587
N-[4-(2-aminoethoxy)phenyl]-2-methylbenzamide
CID 28754762

Frequently Asked Questions

What is the IUPAC name of N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide?
The IUPAC name of N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide (CID 17274184) is N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide.
What is the SMILES notation for N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide?
The canonical SMILES for N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide is Cc1ccccc1C(=O)Nc1cc(C)c(I)c(C)c1.
What is the InChIKey of N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide?
The InChIKey is NTQFAHBOOCKQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16INO/c1-10-6-4-5-7-14(10)16(19)18-13-8-11(2)15(17)12(3)9-13/h4-9H,1-3H3,(H,18,19).
What are the key properties of N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide?
N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide has a molecular weight of 365.21 g/mol, XLogP of 4.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodo-3,5-dimethylphenyl)-2-methylbenzamide is sourced from PubChem (CID 17274184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).