5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide

C10H13FN2O2 — CID 115869418

IUPAC5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide
SMILESCC(CO)N(C)C(=O)c1cncc(F)c1
InChIInChI=1S/C10H13FN2O2/c1-7(6-14)13(2)10(15)8-3-9(11)5-12-4-8/h3-5,7,14H,6H2,1-2H3
InChIKeyZTEXPJZLLQPRMO-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.67
Rot. Bonds3

About 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide

5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide (PubChem CID 115869418) has the molecular formula C10H13FN2O2 and a molecular weight of 212.22 g/mol. Its IUPAC name is 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide
PubChem CID115869418
Molecular FormulaC10H13FN2O2
Molecular Weight212.22 g/mol
Exact Mass212.10
IUPAC Name5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide
SMILESCC(CO)N(C)C(=O)c1cncc(F)c1
InChIInChI=1S/C10H13FN2O2/c1-7(6-14)13(2)10(15)8-3-9(11)5-12-4-8/h3-5,7,14H,6H2,1-2H3
InChIKeyZTEXPJZLLQPRMO-UHFFFAOYSA-N
XLogP0.67
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminopropan-2-yl)-5-fluoro-N-methylpyridine-3-carboxamide
CID 115737346
3-[(5-fluoropyridine-3-carbonyl)-methylamino]-2-methylpropanoic acid
CID 104785540
2-[butan-2-yl-(5-fluoropyridine-3-carbonyl)amino]acetic acid
CID 115755678
4-amino-3,5-difluoro-N-(1-hydroxypropan-2-yl)-N-methylbenzamide
CID 104554287
2,6-dichloro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-4-carboxamide
CID 115869509
N-(1-bromopropan-2-yl)-N,5-dimethylpyridine-3-carboxamide
CID 104556158
N-butyl-5-fluoro-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 115769637
2-ethyl-1-(5-fluoro-3-pyridinyl)butan-1-one
CID 114963530
2-[carboxymethyl-(5-fluoropyridine-3-carbonyl)amino]acetic acid
CID 104785578
N-butan-2-yl-5-fluoropyridine-3-carboxamide
CID 115694418
N-(2-chloropropyl)-5-fluoropyridine-3-carboxamide
CID 104786575
5-hydroxy-N-(1-methoxypropan-2-yl)-N-methylpyridine-3-carboxamide
CID 63866727

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide (CID 115869418) is 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide is CC(CO)N(C)C(=O)c1cncc(F)c1.
What is the InChIKey of 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide?
The InChIKey is ZTEXPJZLLQPRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2/c1-7(6-14)13(2)10(15)8-3-9(11)5-12-4-8/h3-5,7,14H,6H2,1-2H3.
What are the key properties of 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide?
5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide has a molecular weight of 212.22 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 115869418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).