2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide

C20H22N4O2 — CID 68756527

IUPAC2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide
SMILESCN(CCOc1cc(-c2cn[nH]c2)ccc1C(N)=O)Cc1ccccc1
InChIInChI=1S/C20H22N4O2/c1-24(14-15-5-3-2-4-6-15)9-10-26-19-11-16(17-12-22-23-13-17)7-8-18(19)20(21)25/h2-8,11-13H,9-10,14H2,1H3,(H2,21,25)(H,22,23)
InChIKeyAHPLSUIDNIUMRN-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.69
Rot. Bonds8

About 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide

2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide (PubChem CID 68756527) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide.

Molecular Properties

Compound Name2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide
PubChem CID68756527
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide
SMILESCN(CCOc1cc(-c2cn[nH]c2)ccc1C(N)=O)Cc1ccccc1
InChIInChI=1S/C20H22N4O2/c1-24(14-15-5-3-2-4-6-15)9-10-26-19-11-16(17-12-22-23-13-17)7-8-18(19)20(21)25/h2-8,11-13H,9-10,14H2,1H3,(H2,21,25)(H,22,23)
InChIKeyAHPLSUIDNIUMRN-UHFFFAOYSA-N
XLogP2.69
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)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

2-phenylmethoxy-4-(1H-pyrazol-4-yl)benzamide
CID 68761090
2-[2-[benzyl(methyl)arsanyl]ethoxy]-4-(1H-pyrazol-4-yl)benzamide
CID 87578661
4-(1H-pyrazol-4-yl)-2-(2-pyrrolidin-1-ylethoxy)benzamide
CID 68758637
N-[2-[2-(dimethylamino)ethoxy]-4-(1H-pyrazol-4-yl)phenyl]-2-phenylacetamide
CID 90385244
N-[2-(2-ethoxyphenoxy)ethyl]-N-methyl-3-(1H-pyrazol-4-yl)benzamide
CID 50964846
2-[2-[methyl(pyridin-3-ylmethyl)amino]ethoxy]benzenecarbothioamide
CID 43563443
4-[3-[2-[benzyl(methyl)amino]ethoxy]-1,2,4-triazin-6-yl]-2,6-dichlorophenol
CID 135870553
2-[6-[3-[benzyl(methyl)amino]propoxy]-3-pyridinyl]-1H-benzimidazole-4-carboxamide
CID 23433003
2-(methylamino)-5-(1H-pyrazol-4-yl)benzamide
CID 134387946
bis[4-[2-[benzyl(methyl)amino]ethoxy]phenyl]methanone
CID 90685991
2-[2-[2-(dimethylamino)ethoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-N-[2-(dimethylamino)ethyl]-3,4-dihydro-2H-chromene-3,6-dicarboxamide
CID 67237890
3-[2-(2-hydroxyethoxy)-4-(1H-pyrazol-4-yl)phenyl]-1-(2-hydroxyethyl)-1-[(3-methoxyphenyl)methyl]urea
CID 68563409

Frequently Asked Questions

What is the IUPAC name of 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide?
The IUPAC name of 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide (CID 68756527) is 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide.
What is the SMILES notation for 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide?
The canonical SMILES for 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide is CN(CCOc1cc(-c2cn[nH]c2)ccc1C(N)=O)Cc1ccccc1.
What is the InChIKey of 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide?
The InChIKey is AHPLSUIDNIUMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-24(14-15-5-3-2-4-6-15)9-10-26-19-11-16(17-12-22-23-13-17)7-8-18(19)20(21)25/h2-8,11-13H,9-10,14H2,1H3,(H2,21,25)(H,22,23).
What are the key properties of 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide?
2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide has a molecular weight of 350.42 g/mol, XLogP of 2.69, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[benzyl(methyl)amino]ethoxy]-4-(1H-pyrazol-4-yl)benzamide is sourced from PubChem (CID 68756527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).