N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide

C15H16N2O2 — CID 106936106

IUPACN-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide
SMILESCCN(C(=O)c1cccc(O)c1C)c1ccncc1
InChIInChI=1S/C15H16N2O2/c1-3-17(12-7-9-16-10-8-12)15(19)13-5-4-6-14(18)11(13)2/h4-10,18H,3H2,1-2H3
InChIKeySCJOSGDSJKNQAS-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.76
Rot. Bonds3

About N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide

N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide (PubChem CID 106936106) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide
PubChem CID106936106
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide
SMILESCCN(C(=O)c1cccc(O)c1C)c1ccncc1
InChIInChI=1S/C15H16N2O2/c1-3-17(12-7-9-16-10-8-12)15(19)13-5-4-6-14(18)11(13)2/h4-10,18H,3H2,1-2H3
InChIKeySCJOSGDSJKNQAS-UHFFFAOYSA-N
XLogP2.76
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-hydroxy-2-methyl-N-(2-methylphenyl)benzamide
CID 82829552
2-amino-N-ethyl-3-nitro-N-pyridin-4-ylbenzamide
CID 103733862
N-ethyl-2,3-dihydroxy-N-phenylbenzamide
CID 114343845
N-ethyl-3,4-dihydroxy-N-pyridin-4-ylbenzamide
CID 103957153
2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide
CID 106934342
N-ethyl-N-(4-fluorophenyl)-2,3-dihydroxybenzamide
CID 114344262
N-ethyl-3-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 82830028
N-ethyl-3-hydroxy-N-(2-hydroxy-2-methylpropyl)-2-methylbenzamide
CID 82829511
N-ethyl-3-(propylamino)-N-pyridin-4-ylpyridine-4-carboxamide
CID 106937503
3-bromo-N-ethyl-5-methyl-N-pyridin-4-ylbenzamide
CID 104854747
2-chloro-N-ethyl-N-pyridin-4-ylpyridine-4-carboxamide
CID 113236093
N-ethyl-N-(4-fluorophenyl)-2-hydroxy-3-methylbenzamide
CID 60717668

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide?
The IUPAC name of N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide (CID 106936106) is N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide is CCN(C(=O)c1cccc(O)c1C)c1ccncc1.
What is the InChIKey of N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide?
The InChIKey is SCJOSGDSJKNQAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-3-17(12-7-9-16-10-8-12)15(19)13-5-4-6-14(18)11(13)2/h4-10,18H,3H2,1-2H3.
What are the key properties of N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide?
N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide has a molecular weight of 256.31 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 106936106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).