N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide

C10H13FN2O — CID 86726332

IUPACN-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cncc(F)c1
InChIInChI=1S/C10H13FN2O/c1-10(2,3)9(14)13-8-4-7(11)5-12-6-8/h4-6H,1-3H3,(H,13,14)
InChIKeyUGKXKSDTTXFABY-UHFFFAOYSA-N
MW196.22 g/mol
LogP2.21
Rot. Bonds1

About N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide

N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide (PubChem CID 86726332) has the molecular formula C10H13FN2O and a molecular weight of 196.22 g/mol. Its IUPAC name is N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide
PubChem CID86726332
Molecular FormulaC10H13FN2O
Molecular Weight196.22 g/mol
Exact Mass196.10
IUPAC NameN-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cncc(F)c1
InChIInChI=1S/C10H13FN2O/c1-10(2,3)9(14)13-8-4-7(11)5-12-6-8/h4-6H,1-3H3,(H,13,14)
InChIKeyUGKXKSDTTXFABY-UHFFFAOYSA-N
XLogP2.21
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(5-fluoro-3-pyridinyl)carbamoylamino]-2-hydroxy-2-methylpropanoic acid
CID 114254271
N-(5-fluoro-3-pyridinyl)-4-(methylamino)benzamide
CID 114253893
N-(5-fluoro-3-pyridinyl)-4-methoxybenzamide
CID 110872306
2-carbamothioyl-N-(5-fluoro-3-pyridinyl)-3-methylbutanamide
CID 114254833
2-bromo-N-(3,5-difluorophenyl)-2-methylpropanamide
CID 116816877
N-(5-fluoro-3-pyridinyl)morpholine-4-carboxamide
CID 110872339
2-fluoro-N-(5-fluoro-3-pyridinyl)-6-hydroxybenzamide
CID 114217702
N-[3,5-bis(4-fluorophenoxy)phenyl]-2,2-dimethylpropanamide
CID 134112697
N-isoquinolin-6-yl-2,2-dimethylpropanamide
CID 135199975
5-fluoro-N-(2-methylpropyl)pyridin-3-amine
CID 130485397
N-(3,5-dichloro-4-pyridinyl)-2,2-dimethylpropanamide
CID 59829116
N-(4-fluoro-3-methylphenyl)-2,2-dimethylpropanamide
CID 63235993

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide (CID 86726332) is N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1cncc(F)c1.
What is the InChIKey of N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide?
The InChIKey is UGKXKSDTTXFABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c1-10(2,3)9(14)13-8-4-7(11)5-12-6-8/h4-6H,1-3H3,(H,13,14).
What are the key properties of N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide?
N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide has a molecular weight of 196.22 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-3-pyridinyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 86726332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).