N-(2-iodophenyl)-N-methylpropanamide

C10H12INO — CID 15063897

IUPACN-(2-iodophenyl)-N-methylpropanamide
SMILESCCC(=O)N(C)c1ccccc1I
InChIInChI=1S/C10H12INO/c1-3-10(13)12(2)9-7-5-4-6-8(9)11/h4-7H,3H2,1-2H3
InChIKeyFGQNDKCIORPEDL-UHFFFAOYSA-N
MW289.12 g/mol
LogP2.66
Rot. Bonds2

About N-(2-iodophenyl)-N-methylpropanamide

N-(2-iodophenyl)-N-methylpropanamide (PubChem CID 15063897) has the molecular formula C10H12INO and a molecular weight of 289.12 g/mol. Its IUPAC name is N-(2-iodophenyl)-N-methylpropanamide.

Molecular Properties

Compound NameN-(2-iodophenyl)-N-methylpropanamide
PubChem CID15063897
Molecular FormulaC10H12INO
Molecular Weight289.12 g/mol
Exact Mass289.00
IUPAC NameN-(2-iodophenyl)-N-methylpropanamide
SMILESCCC(=O)N(C)c1ccccc1I
InChIInChI=1S/C10H12INO/c1-3-10(13)12(2)9-7-5-4-6-8(9)11/h4-7H,3H2,1-2H3
InChIKeyFGQNDKCIORPEDL-UHFFFAOYSA-N
XLogP2.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.12
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-iodophenyl)-N,2-dimethylpropanamide
CID 11483497
N-(2-iodophenyl)-N-methylbut-2-enamide
CID 71427482
N-(2-iodophenyl)-N-methyl-2-(1-methylindol-3-yl)acetamide
CID 134971385
N-(2-iodophenyl)-N-methyl-2-phenylprop-2-enamide
CID 122384711
2-bromo-N-[2-[(2-bromoacetyl)-methylamino]phenyl]-N-methylacetamide
CID 146415746
(E)-4-(2-iodo-N-methylanilino)-3-methyl-4-oxobut-2-enoic acid
CID 5469950
N-(2-chlorophenyl)-N-methylbutanamide
CID 12936039
N-(2-iodophenyl)-N-methylpyridazine-4-carboxamide
CID 102424758
methyl (E)-4-(2-iodo-N-methylanilino)-3-methyl-4-oxobut-2-enoate
CID 5469949
2-[(2-iodophenyl)methyl-methylamino]acetic acid
CID 66568489
N-(2-methoxyphenyl)-N-methyl-3-oxopentanamide
CID 59676019
3-acetyl-N-(2-iodophenyl)-N,2,2-trimethylcyclobutane-1-carboxamide
CID 90481195

Frequently Asked Questions

What is the IUPAC name of N-(2-iodophenyl)-N-methylpropanamide?
The IUPAC name of N-(2-iodophenyl)-N-methylpropanamide (CID 15063897) is N-(2-iodophenyl)-N-methylpropanamide.
What is the SMILES notation for N-(2-iodophenyl)-N-methylpropanamide?
The canonical SMILES for N-(2-iodophenyl)-N-methylpropanamide is CCC(=O)N(C)c1ccccc1I.
What is the InChIKey of N-(2-iodophenyl)-N-methylpropanamide?
The InChIKey is FGQNDKCIORPEDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12INO/c1-3-10(13)12(2)9-7-5-4-6-8(9)11/h4-7H,3H2,1-2H3.
What are the key properties of N-(2-iodophenyl)-N-methylpropanamide?
N-(2-iodophenyl)-N-methylpropanamide has a molecular weight of 289.12 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iodophenyl)-N-methylpropanamide is sourced from PubChem (CID 15063897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).