(1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone

C22H23N3O3 — CID 16925608

IUPAC(1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone
SMILESO=C(c1cn(Cc2ccccc2)nc1OCc1ccccc1)N1CCOCC1
InChIInChI=1S/C22H23N3O3/c26-22(24-11-13-27-14-12-24)20-16-25(15-18-7-3-1-4-8-18)23-21(20)28-17-19-9-5-2-6-10-19/h1-10,16H,11-15,17H2
InChIKeyOPNDLQKQYSAEON-UHFFFAOYSA-N
MW377.44 g/mol
LogP2.98
Rot. Bonds6

About (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone

(1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone (PubChem CID 16925608) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone
PubChem CID16925608
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name(1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone
SMILESO=C(c1cn(Cc2ccccc2)nc1OCc1ccccc1)N1CCOCC1
InChIInChI=1S/C22H23N3O3/c26-22(24-11-13-27-14-12-24)20-16-25(15-18-7-3-1-4-8-18)23-21(20)28-17-19-9-5-2-6-10-19/h1-10,16H,11-15,17H2
InChIKeyOPNDLQKQYSAEON-UHFFFAOYSA-N
XLogP2.98
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone (CID 16925608) is (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone is O=C(c1cn(Cc2ccccc2)nc1OCc1ccccc1)N1CCOCC1.
What is the InChIKey of (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone?
The InChIKey is OPNDLQKQYSAEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c26-22(24-11-13-27-14-12-24)20-16-25(15-18-7-3-1-4-8-18)23-21(20)28-17-19-9-5-2-6-10-19/h1-10,16H,11-15,17H2.
What are the key properties of (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone?
(1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone has a molecular weight of 377.44 g/mol, XLogP of 2.98, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzyl-3-phenylmethoxypyrazol-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 16925608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).