2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide

C21H26N4O3 — CID 33217745

IUPAC2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(C3CC3)on2)CC1
InChIInChI=1S/C21H26N4O3/c1-2-15-5-3-4-6-17(15)22-20(26)14-24-9-11-25(12-10-24)21(27)18-13-19(28-23-18)16-7-8-16/h3-6,13,16H,2,7-12,14H2,1H3,(H,22,26)
InChIKeyQYZYRHSEQSVCIN-UHFFFAOYSA-N
MW382.46 g/mol
LogP2.51
Rot. Bonds6

About 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide

2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide (PubChem CID 33217745) has the molecular formula C21H26N4O3 and a molecular weight of 382.46 g/mol. Its IUPAC name is 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide
PubChem CID33217745
Molecular FormulaC21H26N4O3
Molecular Weight382.46 g/mol
Exact Mass382.20
IUPAC Name2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(C3CC3)on2)CC1
InChIInChI=1S/C21H26N4O3/c1-2-15-5-3-4-6-17(15)22-20(26)14-24-9-11-25(12-10-24)21(27)18-13-19(28-23-18)16-7-8-16/h3-6,13,16H,2,7-12,14H2,1H3,(H,22,26)
InChIKeyQYZYRHSEQSVCIN-UHFFFAOYSA-N
XLogP2.51
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide
CID 27852116
N-(2-ethylphenyl)-2-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]acetamide
CID 32709303
2-[4-(1-acetylpiperidine-4-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide
CID 9022433
2-[4-[3,5-bis(trifluoromethyl)benzoyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide
CID 27851906
2-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 9436502
2-[4-(2-cyclohexylacetyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide
CID 39762859
3-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 55370076
2-[4-(2,2-dichloro-1-methylcyclopropanecarbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide
CID 42917736
N-(2-ethylphenyl)-2-[4-(1-propylpiperidine-4-carbonyl)piperazin-1-yl]acetamide
CID 86844281
[4-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazine-1-carbonyl]phenyl] acetate
CID 9022475
N-(2-ethylphenyl)-2-[4-[2-(methylamino)acetyl]piperazin-1-yl]acetamide;hydrochloride
CID 120703347
N-(2-ethylphenyl)-2-[4-(4-oxo-3H-phthalazine-1-carbonyl)piperazin-1-yl]acetamide
CID 27851779

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide (CID 33217745) is 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(C3CC3)on2)CC1.
What is the InChIKey of 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
The InChIKey is QYZYRHSEQSVCIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O3/c1-2-15-5-3-4-6-17(15)22-20(26)14-24-9-11-25(12-10-24)21(27)18-13-19(28-23-18)16-7-8-16/h3-6,13,16H,2,7-12,14H2,1H3,(H,22,26).
What are the key properties of 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide has a molecular weight of 382.46 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 33217745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).