N-ethyl-N-iodo-2-pyridin-3-ylacetamide

C9H11IN2O — CID 143532975

IUPACN-ethyl-N-iodo-2-pyridin-3-ylacetamide
SMILESCCN(I)C(=O)Cc1cccnc1
InChIInChI=1S/C9H11IN2O/c1-2-12(10)9(13)6-8-4-3-5-11-7-8/h3-5,7H,2,6H2,1H3
InChIKeyLPXOWIJCBUEQPC-UHFFFAOYSA-N
MW290.10 g/mol
LogP1.82
Rot. Bonds3

About N-ethyl-N-iodo-2-pyridin-3-ylacetamide

N-ethyl-N-iodo-2-pyridin-3-ylacetamide (PubChem CID 143532975) has the molecular formula C9H11IN2O and a molecular weight of 290.10 g/mol. Its IUPAC name is N-ethyl-N-iodo-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-ethyl-N-iodo-2-pyridin-3-ylacetamide
PubChem CID143532975
Molecular FormulaC9H11IN2O
Molecular Weight290.10 g/mol
Exact Mass289.99
IUPAC NameN-ethyl-N-iodo-2-pyridin-3-ylacetamide
SMILESCCN(I)C(=O)Cc1cccnc1
InChIInChI=1S/C9H11IN2O/c1-2-12(10)9(13)6-8-4-3-5-11-7-8/h3-5,7H,2,6H2,1H3
InChIKeyLPXOWIJCBUEQPC-UHFFFAOYSA-N
XLogP1.82
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.10
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-pyridin-3-ylacetohydrazide
CID 116844877
N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 110724689
CID 66868100
CID 66868100
2-pyridin-3-ylacetyl chloride
CID 14697475
N-(pyridin-3-ylmethyl)propanehydrazide
CID 70312825
N-(5-bromopentyl)-N-methyl-2-pyridin-3-ylacetamide
CID 58870383
4-[methyl-(2-pyridin-3-ylacetyl)amino]butanoic acid
CID 62691218
ethyl 3-oxo-4-pyridin-3-ylbutanoate
CID 62551209
4-ethoxy-1-pyridin-3-ylbutan-2-one
CID 94504995
lithium;hydride;2-pyridin-3-ylacetic acid
CID 173026035
methyl 3-[methyl-(2-pyridin-3-ylacetyl)amino]propanoate
CID 62691426
N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide
CID 115277422

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-iodo-2-pyridin-3-ylacetamide?
The IUPAC name of N-ethyl-N-iodo-2-pyridin-3-ylacetamide (CID 143532975) is N-ethyl-N-iodo-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-ethyl-N-iodo-2-pyridin-3-ylacetamide?
The canonical SMILES for N-ethyl-N-iodo-2-pyridin-3-ylacetamide is CCN(I)C(=O)Cc1cccnc1.
What is the InChIKey of N-ethyl-N-iodo-2-pyridin-3-ylacetamide?
The InChIKey is LPXOWIJCBUEQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11IN2O/c1-2-12(10)9(13)6-8-4-3-5-11-7-8/h3-5,7H,2,6H2,1H3.
What are the key properties of N-ethyl-N-iodo-2-pyridin-3-ylacetamide?
N-ethyl-N-iodo-2-pyridin-3-ylacetamide has a molecular weight of 290.10 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-iodo-2-pyridin-3-ylacetamide is sourced from PubChem (CID 143532975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).