6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide

C13H19FN2O2 — CID 113323490

IUPAC6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1cccc(F)n1
InChIInChI=1S/C13H19FN2O2/c1-10(2)9-16(7-8-18-3)13(17)11-5-4-6-12(14)15-11/h4-6,10H,7-9H2,1-3H3
InChIKeyWFVWILGUCKCNFD-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.97
Rot. Bonds6

About 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide

6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide (PubChem CID 113323490) has the molecular formula C13H19FN2O2 and a molecular weight of 254.30 g/mol. Its IUPAC name is 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
PubChem CID113323490
Molecular FormulaC13H19FN2O2
Molecular Weight254.30 g/mol
Exact Mass254.14
IUPAC Name6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1cccc(F)n1
InChIInChI=1S/C13H19FN2O2/c1-10(2)9-16(7-8-18-3)13(17)11-5-4-6-12(14)15-11/h4-6,10H,7-9H2,1-3H3
InChIKeyWFVWILGUCKCNFD-UHFFFAOYSA-N
XLogP1.97
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(diethylamino)ethyl]-6-fluoro-N-(2-methylpropyl)pyridine-2-carboxamide
CID 115497476
ethyl 2-[(6-fluoropyridine-2-carbonyl)-(2-methoxyethyl)amino]acetate
CID 115497491
N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 115497501
3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 113240831
N-(2-methoxyethyl)-6-(methylamino)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 62180313
N-(2-methoxyethyl)-2-(4-methylphenyl)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
CID 134062420
3-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)benzamide
CID 61105794
methyl 4-[2-methoxyethyl(2-methylpropyl)carbamoyl]benzoate
CID 134059038
3-amino-2,6-difluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
CID 79773295
6-fluoro-N-[2-(2-methylpropoxy)ethyl]pyridine-2-carboxamide
CID 115868364
N-(2-methoxyethyl)-N-(2-methylpropyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62180489
6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62161041

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
The IUPAC name of 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide (CID 113323490) is 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide is COCCN(CC(C)C)C(=O)c1cccc(F)n1.
What is the InChIKey of 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
The InChIKey is WFVWILGUCKCNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O2/c1-10(2)9-16(7-8-18-3)13(17)11-5-4-6-12(14)15-11/h4-6,10H,7-9H2,1-3H3.
What are the key properties of 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide has a molecular weight of 254.30 g/mol, XLogP of 1.97, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 113323490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).