N-ethyl-2-iodo-N-methylpyridine-3-carboxamide

C9H11IN2O — CID 130719597

IUPACN-ethyl-2-iodo-N-methylpyridine-3-carboxamide
SMILESCCN(C)C(=O)c1cccnc1I
InChIInChI=1S/C9H11IN2O/c1-3-12(2)9(13)7-5-4-6-11-8(7)10/h4-6H,3H2,1-2H3
InChIKeyDYZCFQFHQXOUGF-UHFFFAOYSA-N
MW290.10 g/mol
LogP1.78
Rot. Bonds2

About N-ethyl-2-iodo-N-methylpyridine-3-carboxamide

N-ethyl-2-iodo-N-methylpyridine-3-carboxamide (PubChem CID 130719597) has the molecular formula C9H11IN2O and a molecular weight of 290.10 g/mol. Its IUPAC name is N-ethyl-2-iodo-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-iodo-N-methylpyridine-3-carboxamide
PubChem CID130719597
Molecular FormulaC9H11IN2O
Molecular Weight290.10 g/mol
Exact Mass289.99
IUPAC NameN-ethyl-2-iodo-N-methylpyridine-3-carboxamide
SMILESCCN(C)C(=O)c1cccnc1I
InChIInChI=1S/C9H11IN2O/c1-3-12(2)9(13)7-5-4-6-11-8(7)10/h4-6H,3H2,1-2H3
InChIKeyDYZCFQFHQXOUGF-UHFFFAOYSA-N
XLogP1.78
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.10
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-bromo-N-ethyl-N-methylbenzamide
CID 43243486
N-ethyl-N,3-dimethylpyridazine-4-carboxamide
CID 130684655
2-(tert-butylamino)-N-ethyl-N-methylbenzamide
CID 18630229
2-fluoro-N-methyl-N-(2-methylbutyl)pyridine-3-carboxamide
CID 107363082
N-ethyl-6-[1-[ethyl(methyl)amino]ethyl]-N-methylquinoline-8-carboxamide
CID 141363571
N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide
CID 62648777
2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 134005816
N-(2-amino-2-oxoethyl)-2-chloro-N-methylpyridine-3-carboxamide
CID 43374214
3-amino-2-chloro-N-ethyl-N-methylbenzamide
CID 112574683
2-chloro-N-(2-hydroxy-2-methylpropyl)-N-methylpyridine-3-carboxamide
CID 79389751
N-benzyl-2-bromo-N-methylpyridine-3-carboxamide
CID 103751706
2-chloro-N-ethyl-N-methylfuran-3-carboxamide
CID 106685381

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-iodo-N-methylpyridine-3-carboxamide?
The IUPAC name of N-ethyl-2-iodo-N-methylpyridine-3-carboxamide (CID 130719597) is N-ethyl-2-iodo-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-2-iodo-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-ethyl-2-iodo-N-methylpyridine-3-carboxamide is CCN(C)C(=O)c1cccnc1I.
What is the InChIKey of N-ethyl-2-iodo-N-methylpyridine-3-carboxamide?
The InChIKey is DYZCFQFHQXOUGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11IN2O/c1-3-12(2)9(13)7-5-4-6-11-8(7)10/h4-6H,3H2,1-2H3.
What are the key properties of N-ethyl-2-iodo-N-methylpyridine-3-carboxamide?
N-ethyl-2-iodo-N-methylpyridine-3-carboxamide has a molecular weight of 290.10 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-iodo-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 130719597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).