N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide

C19H26N4O3 — CID 17120155

IUPACN-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide
SMILESCCN1CCN(C(=O)C2CC(=O)N(c3ccc(NC(C)=O)cc3)C2)CC1
InChIInChI=1S/C19H26N4O3/c1-3-21-8-10-22(11-9-21)19(26)15-12-18(25)23(13-15)17-6-4-16(5-7-17)20-14(2)24/h4-7,15H,3,8-13H2,1-2H3,(H,20,24)
InChIKeyWAQPDPJHJNGEDW-UHFFFAOYSA-N
MW358.44 g/mol
LogP1.16
Rot. Bonds4

About N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide

N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide (PubChem CID 17120155) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide
PubChem CID17120155
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC NameN-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide
SMILESCCN1CCN(C(=O)C2CC(=O)N(c3ccc(NC(C)=O)cc3)C2)CC1
InChIInChI=1S/C19H26N4O3/c1-3-21-8-10-22(11-9-21)19(26)15-12-18(25)23(13-15)17-6-4-16(5-7-17)20-14(2)24/h4-7,15H,3,8-13H2,1-2H3,(H,20,24)
InChIKeyWAQPDPJHJNGEDW-UHFFFAOYSA-N
XLogP1.16
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide?
The IUPAC name of N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide (CID 17120155) is N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide.
What is the SMILES notation for N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide?
The canonical SMILES for N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide is CCN1CCN(C(=O)C2CC(=O)N(c3ccc(NC(C)=O)cc3)C2)CC1.
What is the InChIKey of N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide?
The InChIKey is WAQPDPJHJNGEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-3-21-8-10-22(11-9-21)19(26)15-12-18(25)23(13-15)17-6-4-16(5-7-17)20-14(2)24/h4-7,15H,3,8-13H2,1-2H3,(H,20,24).
What are the key properties of N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide?
N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide has a molecular weight of 358.44 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(4-ethylpiperazine-1-carbonyl)-2-oxopyrrolidin-1-yl]phenyl]acetamide is sourced from PubChem (CID 17120155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).