(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide

C24H28FN3O2 — CID 93221614

IUPAC(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide
SMILESO=C(Nc1ccc(F)cc1)[C@@H](C1CCCC1)N1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C24H28FN3O2/c25-20-10-12-21(13-11-20)26-23(29)22(18-6-4-5-7-18)27-14-16-28(17-15-27)24(30)19-8-2-1-3-9-19/h1-3,8-13,18,22H,4-7,14-17H2,(H,26,29)/t22-/m1/s1
InChIKeyYZSCEUGCJJNNQH-JOCHJYFZSA-N
MW409.50 g/mol
LogP3.78
Rot. Bonds5

About (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide

(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide (PubChem CID 93221614) has the molecular formula C24H28FN3O2 and a molecular weight of 409.50 g/mol. Its IUPAC name is (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide
PubChem CID93221614
Molecular FormulaC24H28FN3O2
Molecular Weight409.50 g/mol
Exact Mass409.22
IUPAC Name(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide
SMILESO=C(Nc1ccc(F)cc1)[C@@H](C1CCCC1)N1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C24H28FN3O2/c25-20-10-12-21(13-11-20)26-23(29)22(18-6-4-5-7-18)27-14-16-28(17-15-27)24(30)19-8-2-1-3-9-19/h1-3,8-13,18,22H,4-7,14-17H2,(H,26,29)/t22-/m1/s1
InChIKeyYZSCEUGCJJNNQH-JOCHJYFZSA-N
XLogP3.78
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.50
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyl-N-(4-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperazin-1-yl]acetamide
CID 46027386
2-cyclopentyl-2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-phenylacetamide
CID 46027426
2-(4-benzoylpiperazin-1-yl)-N-(4-fluorophenyl)propanamide
CID 18082983
(2R)-2-cyclopentyl-2-[4-(3,5-difluorobenzoyl)piperazin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 93222019
2-cyclopentyl-N-(3-fluorophenyl)-2-[4-(4-methylbenzoyl)piperazin-1-yl]acetamide
CID 42843657
2-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(4-propan-2-ylphenyl)acetamide
CID 46027562
4-[(1S)-1-cyclopentyl-2-oxo-2-(propan-2-ylamino)ethyl]-N-(4-fluorophenyl)piperazine-1-carboxamide
CID 93221214
2-cyclopentyl-2-[4-(4-ethylbenzoyl)piperazin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 46027571
2-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-fluorophenyl)acetamide
CID 42843656
(2S)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
CID 93222066
(2S)-2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-N-(2-piperidin-1-ylethyl)acetamide
CID 93210274
(2S)-N-(4-acetamidophenyl)-2-cyclopentyl-2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]acetamide
CID 93222166

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide?
The IUPAC name of (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide (CID 93221614) is (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide?
The canonical SMILES for (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide is O=C(Nc1ccc(F)cc1)[C@@H](C1CCCC1)N1CCN(C(=O)c2ccccc2)CC1.
What is the InChIKey of (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide?
The InChIKey is YZSCEUGCJJNNQH-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H28FN3O2/c25-20-10-12-21(13-11-20)26-23(29)22(18-6-4-5-7-18)27-14-16-28(17-15-27)24(30)19-8-2-1-3-9-19/h1-3,8-13,18,22H,4-7,14-17H2,(H,26,29)/t22-/m1/s1.
What are the key properties of (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide?
(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide has a molecular weight of 409.50 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 93221614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).