4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide

C24H22N2O3 — CID 55532346

IUPAC4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C24H22N2O3/c27-23(18-10-14-22(15-11-18)29-21-6-2-1-3-7-21)25-20-12-8-19(9-13-20)24(28)26-16-4-5-17-26/h1-3,6-15H,4-5,16-17H2,(H,25,27)
InChIKeyKXVDNYYDYICOHT-UHFFFAOYSA-N
MW386.45 g/mol
LogP4.97
Rot. Bonds5

About 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide

4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide (PubChem CID 55532346) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
PubChem CID55532346
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C24H22N2O3/c27-23(18-10-14-22(15-11-18)29-21-6-2-1-3-7-21)25-20-12-8-19(9-13-20)24(28)26-16-4-5-17-26/h1-3,6-15H,4-5,16-17H2,(H,25,27)
InChIKeyKXVDNYYDYICOHT-UHFFFAOYSA-N
XLogP4.97
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(azepane-1-carbonyl)phenyl]benzamide
CID 17153241
N-phenyl-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044285
(4-phenoxyphenyl)-piperidin-1-ylmethanone
CID 112759363
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
4-(phenylcarbamoylamino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 55532549
4-phenoxy-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922461
[4-(4-phenoxybenzoyl)-1,4-diazepan-1-yl]-phenylmethanone
CID 36615147
N-[4-(pyrrolidine-1-carbonyl)phenyl]-4-(trifluoromethoxy)benzamide
CID 30684530
phenyl N-[4-(piperidine-1-carbonyl)phenyl]carbamate
CID 154636920
N-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044668
N-(4-acetamidophenyl)-4-phenoxybenzamide
CID 16651566
4-butoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 17196372

Frequently Asked Questions

What is the IUPAC name of 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide?
The IUPAC name of 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide (CID 55532346) is 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide is O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide?
The InChIKey is KXVDNYYDYICOHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c27-23(18-10-14-22(15-11-18)29-21-6-2-1-3-7-21)25-20-12-8-19(9-13-20)24(28)26-16-4-5-17-26/h1-3,6-15H,4-5,16-17H2,(H,25,27).
What are the key properties of 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide?
4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide has a molecular weight of 386.45 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 55532346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).