2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide

C20H32N4O2 — CID 30969143

IUPAC2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CN1CCN(CC(=O)N(CC)CC)CC1
InChIInChI=1S/C20H32N4O2/c1-4-17-9-7-8-10-18(17)21-19(25)15-22-11-13-23(14-12-22)16-20(26)24(5-2)6-3/h7-10H,4-6,11-16H2,1-3H3,(H,21,25)
InChIKeyHHDLWKVFXNUUPS-UHFFFAOYSA-N
MW360.50 g/mol
LogP1.67
Rot. Bonds8

About 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide

2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide (PubChem CID 30969143) has the molecular formula C20H32N4O2 and a molecular weight of 360.50 g/mol. Its IUPAC name is 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide
PubChem CID30969143
Molecular FormulaC20H32N4O2
Molecular Weight360.50 g/mol
Exact Mass360.25
IUPAC Name2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CN1CCN(CC(=O)N(CC)CC)CC1
InChIInChI=1S/C20H32N4O2/c1-4-17-9-7-8-10-18(17)21-19(25)15-22-11-13-23(14-12-22)16-20(26)24(5-2)6-3/h7-10H,4-6,11-16H2,1-3H3,(H,21,25)
InChIKeyHHDLWKVFXNUUPS-UHFFFAOYSA-N
XLogP1.67
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide (CID 30969143) is 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)CN1CCN(CC(=O)N(CC)CC)CC1.
What is the InChIKey of 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
The InChIKey is HHDLWKVFXNUUPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O2/c1-4-17-9-7-8-10-18(17)21-19(25)15-22-11-13-23(14-12-22)16-20(26)24(5-2)6-3/h7-10H,4-6,11-16H2,1-3H3,(H,21,25).
What are the key properties of 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide?
2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide has a molecular weight of 360.50 g/mol, XLogP of 1.67, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 30969143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).