N-(6-fluoro-2-pyridinyl)-2-methylpropanamide

C9H11FN2O — CID 104820526

IUPACN-(6-fluoro-2-pyridinyl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cccc(F)n1
InChIInChI=1S/C9H11FN2O/c1-6(2)9(13)12-8-5-3-4-7(10)11-8/h3-6H,1-2H3,(H,11,12,13)
InChIKeyIGYUTPQHFBTYTD-UHFFFAOYSA-N
MW182.20 g/mol
LogP1.82
Rot. Bonds2

About N-(6-fluoro-2-pyridinyl)-2-methylpropanamide

N-(6-fluoro-2-pyridinyl)-2-methylpropanamide (PubChem CID 104820526) has the molecular formula C9H11FN2O and a molecular weight of 182.20 g/mol. Its IUPAC name is N-(6-fluoro-2-pyridinyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(6-fluoro-2-pyridinyl)-2-methylpropanamide
PubChem CID104820526
Molecular FormulaC9H11FN2O
Molecular Weight182.20 g/mol
Exact Mass182.09
IUPAC NameN-(6-fluoro-2-pyridinyl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cccc(F)n1
InChIInChI=1S/C9H11FN2O/c1-6(2)9(13)12-8-5-3-4-7(10)11-8/h3-6H,1-2H3,(H,11,12,13)
InChIKeyIGYUTPQHFBTYTD-UHFFFAOYSA-N
XLogP1.82
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-N-(6-fluoro-2-pyridinyl)propanamide
CID 104893703
2-amino-N-(6-fluoro-2-pyridinyl)-3-methylbutanamide
CID 116813269
3-chloro-N-(6-fluoro-2-pyridinyl)-2-methylpropanamide
CID 116813108
(2S,3S)-2-amino-N-(6-fluoro-2-pyridinyl)-3-methylpentanamide
CID 104893705
2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)propanamide
CID 104820692
ethyl 2-amino-3-[(6-fluoro-2-pyridinyl)amino]-3-oxopropanoate
CID 116813320
N-(6-fluoro-2-pyridinyl)-3-(2-methylphenyl)propanamide
CID 113456887
4-amino-N-(6-fluoro-2-pyridinyl)-3-methylbutanamide
CID 116813228
N-(6-fluoro-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 113456880
(2S)-2-amino-N-(6-fluoro-2-pyridinyl)-4-methylsulfanylbutanamide
CID 104893696
N-(6-fluoro-2-pyridinyl)-3,3-dimethylbutanamide
CID 104820780
N-(6-fluoro-2-pyridinyl)-4-(propan-2-ylamino)butanamide
CID 116813202

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2-pyridinyl)-2-methylpropanamide?
The IUPAC name of N-(6-fluoro-2-pyridinyl)-2-methylpropanamide (CID 104820526) is N-(6-fluoro-2-pyridinyl)-2-methylpropanamide.
What is the SMILES notation for N-(6-fluoro-2-pyridinyl)-2-methylpropanamide?
The canonical SMILES for N-(6-fluoro-2-pyridinyl)-2-methylpropanamide is CC(C)C(=O)Nc1cccc(F)n1.
What is the InChIKey of N-(6-fluoro-2-pyridinyl)-2-methylpropanamide?
The InChIKey is IGYUTPQHFBTYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O/c1-6(2)9(13)12-8-5-3-4-7(10)11-8/h3-6H,1-2H3,(H,11,12,13).
What are the key properties of N-(6-fluoro-2-pyridinyl)-2-methylpropanamide?
N-(6-fluoro-2-pyridinyl)-2-methylpropanamide has a molecular weight of 182.20 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-pyridinyl)-2-methylpropanamide is sourced from PubChem (CID 104820526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).