4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide

C24H21N3O2 — CID 55767479

IUPAC4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide
SMILESO=C(Nc1cccc(OCCn2cccn2)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H21N3O2/c28-24(21-12-10-20(11-13-21)19-6-2-1-3-7-19)26-22-8-4-9-23(18-22)29-17-16-27-15-5-14-25-27/h1-15,18H,16-17H2,(H,26,28)
InChIKeyGXJZLJMZYWPZJH-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.88
Rot. Bonds7

About 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide

4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide (PubChem CID 55767479) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide
PubChem CID55767479
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide
SMILESO=C(Nc1cccc(OCCn2cccn2)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H21N3O2/c28-24(21-12-10-20(11-13-21)19-6-2-1-3-7-19)26-22-8-4-9-23(18-22)29-17-16-27-15-5-14-25-27/h1-15,18H,16-17H2,(H,26,28)
InChIKeyGXJZLJMZYWPZJH-UHFFFAOYSA-N
XLogP4.88
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenoxy-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyridine-3-carboxamide
CID 55880460
4-fluoro-N-[2-oxo-2-[3-(2-pyrazol-1-ylethoxy)anilino]ethyl]benzamide
CID 55766765
N-(3-ethoxyphenyl)-4-phenylbenzamide
CID 849227
tert-butyl N-[3-[[3-(2-pyrazol-1-ylethoxy)phenyl]carbamoyl]phenyl]carbamate
CID 55766558
3-(5-phenylfuran-2-yl)-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
CID 55767669
1-(4-nitrophenyl)-N-[3-(2-pyrazol-1-ylethoxy)phenyl]pyrazole-4-carboxamide
CID 55855677
4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 38670554
N-[3-(2-pyrazol-1-ylethoxy)phenyl]-2H-benzotriazole-4-carboxamide
CID 86804269
3-bromo-1-methyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]indole-2-carboxamide
CID 55854489
4-oxo-3-prop-2-enyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide
CID 55766995
N-(2-methylpropyl)-N'-[3-(2-pyrazol-1-ylethoxy)phenyl]oxamide
CID 87039258
N-[3-(2-phenoxyethoxy)phenyl]-4-propoxybenzamide
CID 17123567

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide?
The IUPAC name of 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide (CID 55767479) is 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide.
What is the SMILES notation for 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide?
The canonical SMILES for 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide is O=C(Nc1cccc(OCCn2cccn2)c1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide?
The InChIKey is GXJZLJMZYWPZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2/c28-24(21-12-10-20(11-13-21)19-6-2-1-3-7-19)26-22-8-4-9-23(18-22)29-17-16-27-15-5-14-25-27/h1-15,18H,16-17H2,(H,26,28).
What are the key properties of 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide?
4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide has a molecular weight of 383.45 g/mol, XLogP of 4.88, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide is sourced from PubChem (CID 55767479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).