3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide

C11H13F3N2O2 — CID 55009007

IUPAC3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESCC(C)N(CC(F)(F)F)C(=O)c1ncccc1O
InChIInChI=1S/C11H13F3N2O2/c1-7(2)16(6-11(12,13)14)10(18)9-8(17)4-3-5-15-9/h3-5,7,17H,6H2,1-2H3
InChIKeyFBZSHISPJPFDTF-UHFFFAOYSA-N
MW262.23 g/mol
LogP2.20
Rot. Bonds3

About 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide

3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (PubChem CID 55009007) has the molecular formula C11H13F3N2O2 and a molecular weight of 262.23 g/mol. Its IUPAC name is 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
PubChem CID55009007
Molecular FormulaC11H13F3N2O2
Molecular Weight262.23 g/mol
Exact Mass262.09
IUPAC Name3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESCC(C)N(CC(F)(F)F)C(=O)c1ncccc1O
InChIInChI=1S/C11H13F3N2O2/c1-7(2)16(6-11(12,13)14)10(18)9-8(17)4-3-5-15-9/h3-5,7,17H,6H2,1-2H3
InChIKeyFBZSHISPJPFDTF-UHFFFAOYSA-N
XLogP2.20
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-N-propan-2-yl-N-propylpyridine-2-carboxamide
CID 60923482
2-[(3-hydroxypyridine-2-carbonyl)-propan-2-ylamino]acetic acid
CID 54893003
6-bromo-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 103889742
4-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)benzamide
CID 55009058
N-(3,3-dimethylbutan-2-yl)-3-hydroxy-N-methylpyridine-2-carboxamide
CID 55009248
3-bromo-N-propan-2-yl-N-propylpyridine-2-carboxamide
CID 107517877
2-hydrazinyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)benzamide
CID 62235512
3-bromo-N-ethyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 107518835
2-(methylamino)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 62179572
4-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)-1,2,5-oxadiazole-3-carboxamide
CID 55135044
3-[(3-bromopyridine-2-carbonyl)-propan-2-ylamino]propanoic acid
CID 107517011
2,6-dichloro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 113228638

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (CID 55009007) is 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is CC(C)N(CC(F)(F)F)C(=O)c1ncccc1O.
What is the InChIKey of 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The InChIKey is FBZSHISPJPFDTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O2/c1-7(2)16(6-11(12,13)14)10(18)9-8(17)4-3-5-15-9/h3-5,7,17H,6H2,1-2H3.
What are the key properties of 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide has a molecular weight of 262.23 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is sourced from PubChem (CID 55009007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).