2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide

C21H23N5O2 — CID 110121786

IUPAC2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
SMILESCC(=O)NCc1cnn(-c2ccccc2C(=O)N(C)CCc2ccccn2)c1
InChIInChI=1S/C21H23N5O2/c1-16(27)23-13-17-14-24-26(15-17)20-9-4-3-8-19(20)21(28)25(2)12-10-18-7-5-6-11-22-18/h3-9,11,14-15H,10,12-13H2,1-2H3,(H,23,27)
InChIKeyQOCZNGIUCBQTJJ-UHFFFAOYSA-N
MW377.45 g/mol
LogP2.22
Rot. Bonds7

About 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide

2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide (PubChem CID 110121786) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
PubChem CID110121786
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC Name2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
SMILESCC(=O)NCc1cnn(-c2ccccc2C(=O)N(C)CCc2ccccn2)c1
InChIInChI=1S/C21H23N5O2/c1-16(27)23-13-17-14-24-26(15-17)20-9-4-3-8-19(20)21(28)25(2)12-10-18-7-5-6-11-22-18/h3-9,11,14-15H,10,12-13H2,1-2H3,(H,23,27)
InChIKeyQOCZNGIUCBQTJJ-UHFFFAOYSA-N
XLogP2.22
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)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-[4-(acetamidomethyl)pyrazol-1-yl]-N-(2-pyridin-2-ylethyl)benzamide
CID 110121784
2-[4-(acetamidomethyl)pyrazol-1-yl]-N-(2-piperidin-1-ylethyl)benzamide
CID 110121728
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
3-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115646430
3-chloro-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 66463234
2-methyl-N-[3-[methyl(2-pyridin-2-ylethyl)amino]-3-oxopropyl]benzamide
CID 134008685
5-amino-1-(2,5-dimethylphenyl)-N-methyl-N-(2-pyridin-2-ylethyl)pyrazole-4-carboxamide
CID 118738384
1-(2-fluorophenyl)-N-methyl-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide
CID 60589600
4-ethoxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 56809954
2-fluoro-4-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 103941324
N-methyl-2-piperidin-1-ylsulfonyl-N-(2-pyridin-2-ylethyl)benzamide
CID 78795855
4-(acetamidomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 18107584

Frequently Asked Questions

What is the IUPAC name of 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide?
The IUPAC name of 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide (CID 110121786) is 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide?
The canonical SMILES for 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide is CC(=O)NCc1cnn(-c2ccccc2C(=O)N(C)CCc2ccccn2)c1.
What is the InChIKey of 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide?
The InChIKey is QOCZNGIUCBQTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c1-16(27)23-13-17-14-24-26(15-17)20-9-4-3-8-19(20)21(28)25(2)12-10-18-7-5-6-11-22-18/h3-9,11,14-15H,10,12-13H2,1-2H3,(H,23,27).
What are the key properties of 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide?
2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide has a molecular weight of 377.45 g/mol, XLogP of 2.22, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(acetamidomethyl)pyrazol-1-yl]-N-methyl-N-(2-pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 110121786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).