N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide

C17H13IN2O2 — CID 112797610

IUPACN-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide
SMILESO=C(COc1cccc2ccccc12)Nc1ccc(I)cn1
InChIInChI=1S/C17H13IN2O2/c18-13-8-9-16(19-10-13)20-17(21)11-22-15-7-3-5-12-4-1-2-6-14(12)15/h1-10H,11H2,(H,19,20,21)
InChIKeyIFSZIBUGDNNDMX-UHFFFAOYSA-N
MW404.21 g/mol
LogP3.86
Rot. Bonds4

About N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide

N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide (PubChem CID 112797610) has the molecular formula C17H13IN2O2 and a molecular weight of 404.21 g/mol. Its IUPAC name is N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide
PubChem CID112797610
Molecular FormulaC17H13IN2O2
Molecular Weight404.21 g/mol
Exact Mass404.00
IUPAC NameN-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide
SMILESO=C(COc1cccc2ccccc12)Nc1ccc(I)cn1
InChIInChI=1S/C17H13IN2O2/c18-13-8-9-16(19-10-13)20-17(21)11-22-15-7-3-5-12-4-1-2-6-14(12)15/h1-10H,11H2,(H,19,20,21)
InChIKeyIFSZIBUGDNNDMX-UHFFFAOYSA-N
XLogP3.86
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.21
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-naphthalen-1-yloxyacetamide
CID 22776946
N-(5-methyl-1,3-thiazol-2-yl)-2-naphthalen-1-yloxyacetamide
CID 2673025
N-(2-methylnaphthalen-1-yl)-2-naphthalen-1-yloxyacetamide
CID 856175
N-(4-methoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 835733
N'-acetyl-2-naphthalen-1-yloxyacetohydrazide
CID 922179
N-(3-chlorophenyl)-2-naphthalen-1-yloxyacetamide
CID 954547
2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide
CID 21213308
N-tert-butyl-2-naphthalen-1-yloxyacetamide
CID 954544
N-(5-iodo-2-pyridinyl)-3-phenoxypropanamide
CID 65098781
N-[4-(dimethylamino)phenyl]-2-naphthalen-1-yloxyacetamide
CID 2327581
2-naphthalen-1-yloxy-N-(4-naphthalen-1-yl-1,3-thiazol-2-yl)acetamide
CID 4038077
N-(benzylcarbamoyl)-2-naphthalen-1-yloxyacetamide
CID 7860175

Frequently Asked Questions

What is the IUPAC name of N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide (CID 112797610) is N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide is O=C(COc1cccc2ccccc12)Nc1ccc(I)cn1.
What is the InChIKey of N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide?
The InChIKey is IFSZIBUGDNNDMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13IN2O2/c18-13-8-9-16(19-10-13)20-17(21)11-22-15-7-3-5-12-4-1-2-6-14(12)15/h1-10H,11H2,(H,19,20,21).
What are the key properties of N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide?
N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide has a molecular weight of 404.21 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-iodo-2-pyridinyl)-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 112797610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).