N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide

C11H15FN2O — CID 63973149

IUPACN-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide
SMILESCCN(C(=O)c1ccc(F)nc1)C(C)C
InChIInChI=1S/C11H15FN2O/c1-4-14(8(2)3)11(15)9-5-6-10(12)13-7-9/h5-8H,4H2,1-3H3
InChIKeyYBOMRZXQOKKKGR-UHFFFAOYSA-N
MW210.25 g/mol
LogP2.09
Rot. Bonds3

About N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide

N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 63973149) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide
PubChem CID63973149
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC NameN-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide
SMILESCCN(C(=O)c1ccc(F)nc1)C(C)C
InChIInChI=1S/C11H15FN2O/c1-4-14(8(2)3)11(15)9-5-6-10(12)13-7-9/h5-8H,4H2,1-3H3
InChIKeyYBOMRZXQOKKKGR-UHFFFAOYSA-N
XLogP2.09
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-bromo-N-ethyl-N-propan-2-ylpyridine-3-carboxamide
CID 66463467
N-ethyl-6-fluoro-N-methylpyridine-3-carboxamide
CID 63972560
6-fluoro-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 63978005
6-fluoro-N-methyl-N-(3-methylbutan-2-yl)pyridine-3-carboxamide
CID 63972005
6-fluoro-N-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 63979148
2-[(6-fluoropyridine-3-carbonyl)-methylamino]propanoic acid
CID 103804135
6-methyl-N-propan-2-yl-N-propylpyridine-3-carboxamide
CID 10421027
N-butan-2-yl-6-chloro-N-ethylpyridine-3-carboxamide
CID 43274567
N-(cyclopropylmethyl)-N-ethyl-6-fluoropyridine-3-carboxamide
CID 63979001
6-fluoro-N-(2-hydroxypropyl)pyridine-3-carboxamide
CID 63980450
N-[2-(dimethylamino)-2-oxoethyl]-6-fluoro-N-methylpyridine-3-carboxamide
CID 63971406
N-ethyl-3-fluoro-N-propan-2-ylbenzamide;methane
CID 142548394

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide (CID 63973149) is N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide is CCN(C(=O)c1ccc(F)nc1)C(C)C.
What is the InChIKey of N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is YBOMRZXQOKKKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-4-14(8(2)3)11(15)9-5-6-10(12)13-7-9/h5-8H,4H2,1-3H3.
What are the key properties of N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide?
N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 210.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 63973149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).