N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide

C11H15IN2O — CID 977179

IUPACN-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCc1cc(I)cnc1NC(=O)C(C)(C)C
InChIInChI=1S/C11H15IN2O/c1-7-5-8(12)6-13-9(7)14-10(15)11(2,3)4/h5-6H,1-4H3,(H,13,14,15)
InChIKeyLRQWADXLVLGBSY-UHFFFAOYSA-N
MW318.16 g/mol
LogP2.98
Rot. Bonds1

About N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide

N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide (PubChem CID 977179) has the molecular formula C11H15IN2O and a molecular weight of 318.16 g/mol. Its IUPAC name is N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide
PubChem CID977179
Molecular FormulaC11H15IN2O
Molecular Weight318.16 g/mol
Exact Mass318.02
IUPAC NameN-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCc1cc(I)cnc1NC(=O)C(C)(C)C
InChIInChI=1S/C11H15IN2O/c1-7-5-8(12)6-13-9(7)14-10(15)11(2,3)4/h5-6H,1-4H3,(H,13,14,15)
InChIKeyLRQWADXLVLGBSY-UHFFFAOYSA-N
XLogP2.98
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.16
LogP ≤ 52.98
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

2-Acetamidopyridine
CID 72929
1-(3-Methyl-pyridin-2-YL)-3-phenyl-urea
CID 790718
N-(pyridin-2-yl)prop-2-enamide
CID 9920419
3-oxo-N-2-pyridylbutyramide
CID 74260
2-(Pivaloylamino)pyridine
CID 1051519
N-methyl-N-(pyridin-2-yl)acetamide
CID 3786664
3,5-Dimethylpyridin-2-amine
CID 3016310
2-cyano-N-(pyridin-2-yl)acetamide
CID 706187
2-(N-Boc-Amino)-3-methylpyridine
CID 11745848
N-(5-methylpyridin-2-yl)-4-phenylbutanamide
CID 838086
N-benzyl-2,2-dimethyl-N-(pyridin-2-yl)propanamide
CID 1122454
N,N'-bis(5-methylpyridin-2-yl)ethanediamide
CID 2166281

Frequently Asked Questions

What is the IUPAC name of N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide (CID 977179) is N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide is Cc1cc(I)cnc1NC(=O)C(C)(C)C.
What is the InChIKey of N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide?
The InChIKey is LRQWADXLVLGBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15IN2O/c1-7-5-8(12)6-13-9(7)14-10(15)11(2,3)4/h5-6H,1-4H3,(H,13,14,15).
What are the key properties of N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide?
N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide has a molecular weight of 318.16 g/mol, XLogP of 2.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-iodo-3-methyl-2-pyridinyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 977179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).