N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide

C15H14F2N2O2 — CID 63858873

IUPACN-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide
SMILESCCN(Cc1ccc(F)c(F)c1)C(=O)c1cncc(O)c1
InChIInChI=1S/C15H14F2N2O2/c1-2-19(9-10-3-4-13(16)14(17)5-10)15(21)11-6-12(20)8-18-7-11/h3-8,20H,2,9H2,1H3
InChIKeyBJEVJKIWXLHLKA-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.73
Rot. Bonds4

About N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide

N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide (PubChem CID 63858873) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide
PubChem CID63858873
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC NameN-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide
SMILESCCN(Cc1ccc(F)c(F)c1)C(=O)c1cncc(O)c1
InChIInChI=1S/C15H14F2N2O2/c1-2-19(9-10-3-4-13(16)14(17)5-10)15(21)11-6-12(20)8-18-7-11/h3-8,20H,2,9H2,1H3
InChIKeyBJEVJKIWXLHLKA-UHFFFAOYSA-N
XLogP2.73
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3,4-difluorophenyl)methyl]-N-ethyl-2H-triazole-4-carboxamide
CID 112733333
N-benzyl-5-(3,4-difluoroanilino)-N-ethylpyridine-3-carboxamide
CID 109234812
5-bromo-N-[(3,4-difluorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60729547
N-[(4-aminophenyl)methyl]-N-ethyl-5-fluoropyridine-3-carboxamide
CID 104785376
3-chloro-N-[(3,4-difluorophenyl)methyl]-N-ethylpyridine-4-carboxamide
CID 66483932
N-ethyl-5-hydroxy-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 63850012
5-chloro-N-[(3,4-difluorophenyl)methyl]-N-ethylpyrazine-2-carboxamide
CID 107244907
N-ethyl-5-hydroxy-N-prop-2-ynylpyridine-3-carboxamide
CID 79725826
N-[3-(diethylamino)propyl]-N-ethyl-5-hydroxypyridine-3-carboxamide
CID 102993953
3-amino-N-[(3,4-difluorophenyl)methyl]-N-ethyl-1H-pyrazole-5-carboxamide
CID 64523483
N-ethyl-N-(4-fluorophenyl)-5-hydroxypyridine-3-carboxamide
CID 63859639
N-[(3-aminophenyl)methyl]-N-ethyl-3,4-difluorobenzamide
CID 43458956

Frequently Asked Questions

What is the IUPAC name of N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide (CID 63858873) is N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide is CCN(Cc1ccc(F)c(F)c1)C(=O)c1cncc(O)c1.
What is the InChIKey of N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide?
The InChIKey is BJEVJKIWXLHLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c1-2-19(9-10-3-4-13(16)14(17)5-10)15(21)11-6-12(20)8-18-7-11/h3-8,20H,2,9H2,1H3.
What are the key properties of N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide?
N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide has a molecular weight of 292.29 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,4-difluorophenyl)methyl]-N-ethyl-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63858873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).