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

C12H15FN2O2 — CID 115497501

IUPACN-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCOCCN(C(=O)c1cccc(F)n1)C1CC1
InChIInChI=1S/C12H15FN2O2/c1-17-8-7-15(9-5-6-9)12(16)10-3-2-4-11(13)14-10/h2-4,9H,5-8H2,1H3
InChIKeyKKABYYFREAEGEW-UHFFFAOYSA-N
MW238.26 g/mol
LogP1.47
Rot. Bonds5

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

N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide (PubChem CID 115497501) has the molecular formula C12H15FN2O2 and a molecular weight of 238.26 g/mol. Its IUPAC name is N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
PubChem CID115497501
Molecular FormulaC12H15FN2O2
Molecular Weight238.26 g/mol
Exact Mass238.11
IUPAC NameN-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCOCCN(C(=O)c1cccc(F)n1)C1CC1
InChIInChI=1S/C12H15FN2O2/c1-17-8-7-15(9-5-6-9)12(16)10-3-2-4-11(13)14-10/h2-4,9H,5-8H2,1H3
InChIKeyKKABYYFREAEGEW-UHFFFAOYSA-N
XLogP1.47
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.26
LogP ≤ 51.47
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-cyclopropyl-6-fluoro-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 115497708
6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 113323490
ethyl 2-[(6-fluoropyridine-2-carbonyl)-(2-methoxyethyl)amino]acetate
CID 115497491
N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 139945134
N-cyclopropyl-2-hydroxy-N-(2-methoxyethyl)-3-methylbenzamide
CID 60794549
N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374972
N-(cyclopentylmethyl)-6-fluoropyridine-2-carboxamide
CID 115496783
3-[3-[cyclopropyl(2-methoxyethyl)carbamoyl]phenyl]prop-2-enoic acid
CID 76907075
N-cyclopropyl-N-(2-methoxyethyl)-3H-benzimidazole-5-carboxamide
CID 54876843
6-fluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridine-2-carboxamide
CID 113342974
2-bromo-6-fluoro-N-(2-methoxyethyl)-N-(thiolan-3-yl)benzamide
CID 114559503
N-(2-ethoxyethyl)-6-fluoro-N-methylpyridine-2-carboxamide
CID 115498047

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide (CID 115497501) is N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide is COCCN(C(=O)c1cccc(F)n1)C1CC1.
What is the InChIKey of N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide?
The InChIKey is KKABYYFREAEGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O2/c1-17-8-7-15(9-5-6-9)12(16)10-3-2-4-11(13)14-10/h2-4,9H,5-8H2,1H3.
What are the key properties of N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide?
N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide has a molecular weight of 238.26 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 115497501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).