N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide

C14H17N3O2 — CID 47466877

IUPACN-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide
SMILESCCN(Cc1cnn(C)c1)C(=O)c1ccccc1O
InChIInChI=1S/C14H17N3O2/c1-3-17(10-11-8-15-16(2)9-11)14(19)12-6-4-5-7-13(12)18/h4-9,18H,3,10H2,1-2H3
InChIKeyKWSRLXRRLDEKLO-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.79
Rot. Bonds4

About N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide

N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide (PubChem CID 47466877) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide.

Molecular Properties

Compound NameN-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide
PubChem CID47466877
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide
SMILESCCN(Cc1cnn(C)c1)C(=O)c1ccccc1O
InChIInChI=1S/C14H17N3O2/c1-3-17(10-11-8-15-16(2)9-11)14(19)12-6-4-5-7-13(12)18/h4-9,18H,3,10H2,1-2H3
InChIKeyKWSRLXRRLDEKLO-UHFFFAOYSA-N
XLogP1.79
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ethyl 4-(2-hydroxybenzoyl)pyrazole-1-carboxylate
CID 4792887
N-[(E)-(1-benzyl-3,5-dimethylpyrazol-4-yl)methylideneamino]-2-hydroxybenzamide
CID 6890491
(E)-3-(1,5-dimethylpyrazol-4-yl)-1-(2-hydroxyphenyl)prop-2-en-1-one
CID 6175261
[3-(Dimethylamino)phenyl]-[4-(5-fluoro-2-hydroxybenzoyl)pyrazol-1-yl]methanone
CID 2999309
3,5-dichloro-2-[3-(1-methyl-1H-pyrazol-4-yl)pyrrolidine-1-carbonyl]phenol
CID 126773042
Tert-butyl 4-(2-hydroxybenzoyl)pyrazole-1-carboxylate
CID 4792870
2-{1-[(3R,6R)-1-{[2-(Difluoromethoxy)phenyl]carbonyl}-6-methylpiperidin-3-yl]-1H-pyrazol-4-yl}propan-2-ol
CID 121314187
2-{1-[(3R,6R)-6-Methyl-1-{[2-(trifluoromethoxy)phenyl]carbonyl} piperidin-3-yl]-1H-pyrazol-4-yl}propan-2-ol
CID 121344813
[1-(2-Fluorobenzoyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone
CID 4827601
[4-(2-Hydroxybenzoyl)pyrazol-1-yl]-phenylmethanone
CID 3914259
1-[2-[4-(2-Hydroxybenzoyl)pyrazol-1-yl]-2-oxoethyl]pyrrolidin-2-one
CID 4789383
[4-(2-Hydroxybenzoyl)pyrazol-1-yl]-(4-hydroxyphenyl)methanone
CID 2537626

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide?
The IUPAC name of N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide (CID 47466877) is N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide.
What is the SMILES notation for N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide?
The canonical SMILES for N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide is CCN(Cc1cnn(C)c1)C(=O)c1ccccc1O.
What is the InChIKey of N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide?
The InChIKey is KWSRLXRRLDEKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-17(10-11-8-15-16(2)9-11)14(19)12-6-4-5-7-13(12)18/h4-9,18H,3,10H2,1-2H3.
What are the key properties of N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide?
N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide has a molecular weight of 259.31 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]benzamide is sourced from PubChem (CID 47466877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).