N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide

C14H13IN2O — CID 1017624

IUPACN-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide
SMILESCc1nc(NC(=O)Cc2ccccc2)ccc1I
InChIInChI=1S/C14H13IN2O/c1-10-12(15)7-8-13(16-10)17-14(18)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,16,17,18)
InChIKeyQFFQKEJWFNAUEB-UHFFFAOYSA-N
MW352.18 g/mol
LogP3.18
Rot. Bonds3

About N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide

N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide (PubChem CID 1017624) has the molecular formula C14H13IN2O and a molecular weight of 352.18 g/mol. Its IUPAC name is N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide
PubChem CID1017624
Molecular FormulaC14H13IN2O
Molecular Weight352.18 g/mol
Exact Mass352.01
IUPAC NameN-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide
SMILESCc1nc(NC(=O)Cc2ccccc2)ccc1I
InChIInChI=1S/C14H13IN2O/c1-10-12(15)7-8-13(16-10)17-14(18)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,16,17,18)
InChIKeyQFFQKEJWFNAUEB-UHFFFAOYSA-N
XLogP3.18
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.18
LogP ≤ 53.18
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

N-(5-iodo-6-methyl-2-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 75448255
N-[6-methyl-5-(1-methylpyrazol-4-yl)-2-pyridinyl]-2-phenylacetamide
CID 155597300
(6-ethyl-5-iodo-2-pyridinyl)carbamic acid
CID 150133379
N-(5-iodo-6-methyl-2-pyridinyl)cyclobutanecarboxamide
CID 119042245
N-(4-methyl-1,3-oxazol-2-yl)-2-phenylacetamide
CID 12556858
N-(5-acetyl-2,6-dimethylpyrimidin-4-yl)-2-phenylacetamide
CID 873978
N-(6-ethylpyridazin-3-yl)-2-phenylacetamide
CID 123748541
N-(4-methyl-2-pyridinyl)-2-phenylacetamide
CID 4232423
4-methyl-2-[(2-phenylacetyl)amino]-1,3-thiazole-5-carboxylic acid
CID 28803701
N-(5-amino-6-methyl-2-pyridinyl)-2-(4-chlorophenyl)acetamide
CID 82330943
N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]-2-phenylacetamide
CID 50748504
2-phenyl-N-[6-(propylamino)pyridazin-3-yl]acetamide
CID 113037818

Frequently Asked Questions

What is the IUPAC name of N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide?
The IUPAC name of N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide (CID 1017624) is N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide.
What is the SMILES notation for N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide?
The canonical SMILES for N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide is Cc1nc(NC(=O)Cc2ccccc2)ccc1I.
What is the InChIKey of N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide?
The InChIKey is QFFQKEJWFNAUEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13IN2O/c1-10-12(15)7-8-13(16-10)17-14(18)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,16,17,18).
What are the key properties of N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide?
N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide has a molecular weight of 352.18 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-iodo-6-methyl-2-pyridinyl)-2-phenylacetamide is sourced from PubChem (CID 1017624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).