2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide

C22H23ClN4O2 — CID 46977302

IUPAC2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
SMILESO=C(Nc1cccc(Cn2cccn2)c1)C(c1ccc(Cl)cc1)N1CCOCC1
InChIInChI=1S/C22H23ClN4O2/c23-19-7-5-18(6-8-19)21(26-11-13-29-14-12-26)22(28)25-20-4-1-3-17(15-20)16-27-10-2-9-24-27/h1-10,15,21H,11-14,16H2,(H,25,28)
InChIKeySITNGWTZGWNGGB-UHFFFAOYSA-N
MW410.91 g/mol
LogP3.60
Rot. Bonds6

About 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide

2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide (PubChem CID 46977302) has the molecular formula C22H23ClN4O2 and a molecular weight of 410.91 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
PubChem CID46977302
Molecular FormulaC22H23ClN4O2
Molecular Weight410.91 g/mol
Exact Mass410.15
IUPAC Name2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
SMILESO=C(Nc1cccc(Cn2cccn2)c1)C(c1ccc(Cl)cc1)N1CCOCC1
InChIInChI=1S/C22H23ClN4O2/c23-19-7-5-18(6-8-19)21(26-11-13-29-14-12-26)22(28)25-20-4-1-3-17(15-20)16-27-10-2-9-24-27/h1-10,15,21H,11-14,16H2,(H,25,28)
InChIKeySITNGWTZGWNGGB-UHFFFAOYSA-N
XLogP3.60
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.91
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide 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

(2R)-2-phenyl-2-piperidin-1-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 92613321
N-[3-(pyrazol-1-ylmethyl)phenyl]morpholine-4-carboxamide
CID 34688755
N-(4-chlorophenyl)-2-[3-(pyrazol-1-ylmethyl)anilino]propanamide
CID 55629793
N-[3-(pyrazol-1-ylmethyl)phenyl]oxane-4-carboxamide
CID 39190126
2-amino-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide
CID 43697329
(2S)-2-(4-chlorophenyl)-N-(2,6-dimethylphenyl)-2-morpholin-4-ylacetamide
CID 7279324
1-[(2-morpholin-4-yl-3-pyridinyl)methyl]-3-[3-(pyrazol-1-ylmethyl)phenyl]urea
CID 47033840
(2S)-2-(4-chlorophenyl)-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-morpholin-4-ylacetamide
CID 93242325
2-amino-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 43697313
2-(4-acetylpiperazin-1-yl)-2-oxo-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 87039923
(2S)-2-amino-3-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]pentanamide
CID 61172469
N-[3-(ethylaminomethyl)phenyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
CID 119438130

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide (CID 46977302) is 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide is O=C(Nc1cccc(Cn2cccn2)c1)C(c1ccc(Cl)cc1)N1CCOCC1.
What is the InChIKey of 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide?
The InChIKey is SITNGWTZGWNGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23ClN4O2/c23-19-7-5-18(6-8-19)21(26-11-13-29-14-12-26)22(28)25-20-4-1-3-17(15-20)16-27-10-2-9-24-27/h1-10,15,21H,11-14,16H2,(H,25,28).
What are the key properties of 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide?
2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide has a molecular weight of 410.91 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-morpholin-4-yl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide is sourced from PubChem (CID 46977302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).