2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide

C14H14IN3O — CID 62166650

IUPAC2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ccc(I)cc2)ccn1
InChIInChI=1S/C14H14IN3O/c1-2-16-13-9-10(7-8-17-13)14(19)18-12-5-3-11(15)4-6-12/h3-9H,2H2,1H3,(H,16,17)(H,18,19)
InChIKeyBIHLJPJLCYKILU-UHFFFAOYSA-N
MW367.19 g/mol
LogP3.37
Rot. Bonds4

About 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide

2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide (PubChem CID 62166650) has the molecular formula C14H14IN3O and a molecular weight of 367.19 g/mol. Its IUPAC name is 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide
PubChem CID62166650
Molecular FormulaC14H14IN3O
Molecular Weight367.19 g/mol
Exact Mass367.02
IUPAC Name2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ccc(I)cc2)ccn1
InChIInChI=1S/C14H14IN3O/c1-2-16-13-9-10(7-8-17-13)14(19)18-12-5-3-11(15)4-6-12/h3-9H,2H2,1H3,(H,16,17)(H,18,19)
InChIKeyBIHLJPJLCYKILU-UHFFFAOYSA-N
XLogP3.37
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.19
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(dimethylamino)phenyl]-2-(ethylamino)pyridine-4-carboxamide
CID 62168755
N-(4-bromo-3,5-dimethylphenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 107578271
N-(3-chloro-4-fluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62166984
2-(ethylamino)-N-(2-ethylphenyl)pyridine-4-carboxamide
CID 62165184
N-(3-chloro-4-cyanophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62165803
2-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 62167570
N-(2-chloro-4-methylphenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62165610
N-(2,3-difluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62179197
5-(ethylamino)-N-(4-iodophenyl)pyrazine-2-carboxamide
CID 107374377
N-(4,6-dimethyl-2-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide
CID 115750707
N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62166855
2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114914267

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide (CID 62166650) is 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide is CCNc1cc(C(=O)Nc2ccc(I)cc2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide?
The InChIKey is BIHLJPJLCYKILU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14IN3O/c1-2-16-13-9-10(7-8-17-13)14(19)18-12-5-3-11(15)4-6-12/h3-9H,2H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide?
2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide has a molecular weight of 367.19 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 62166650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).