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

C19H24N4O3 — CID 27852116

IUPACN-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide
SMILESCCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(C)no2)CC1
InChIInChI=1S/C19H24N4O3/c1-3-15-6-4-5-7-16(15)20-18(24)13-22-8-10-23(11-9-22)19(25)17-12-14(2)21-26-17/h4-7,12H,3,8-11,13H2,1-2H3,(H,20,24)
InChIKeyMFYPWVOLRBYDMQ-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.94
Rot. Bonds5

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

N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide (PubChem CID 27852116) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide
PubChem CID27852116
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide
SMILESCCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(C)no2)CC1
InChIInChI=1S/C19H24N4O3/c1-3-15-6-4-5-7-16(15)20-18(24)13-22-8-10-23(11-9-22)19(25)17-12-14(2)21-26-17/h4-7,12H,3,8-11,13H2,1-2H3,(H,20,24)
InChIKeyMFYPWVOLRBYDMQ-UHFFFAOYSA-N
XLogP1.94
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide (CID 27852116) is N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide is CCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(C)no2)CC1.
What is the InChIKey of N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide?
The InChIKey is MFYPWVOLRBYDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-3-15-6-4-5-7-16(15)20-18(24)13-22-8-10-23(11-9-22)19(25)17-12-14(2)21-26-17/h4-7,12H,3,8-11,13H2,1-2H3,(H,20,24).
What are the key properties of N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide?
N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide has a molecular weight of 356.43 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 27852116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).