N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide

C20H29N3O3 — CID 55501528

IUPACN-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
SMILESCCc1ccccc1NC(=O)CN1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C20H29N3O3/c1-2-16-6-3-4-8-18(16)21-19(24)15-22-9-5-7-17(14-22)20(25)23-10-12-26-13-11-23/h3-4,6,8,17H,2,5,7,9-15H2,1H3,(H,21,24)
InChIKeyWBAPCVNMJRCFGJ-UHFFFAOYSA-N
MW359.47 g/mol
LogP1.76
Rot. Bonds5

About N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide

N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide (PubChem CID 55501528) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
PubChem CID55501528
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC NameN-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
SMILESCCc1ccccc1NC(=O)CN1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C20H29N3O3/c1-2-16-6-3-4-8-18(16)21-19(24)15-22-9-5-7-17(14-22)20(25)23-10-12-26-13-11-23/h3-4,6,8,17H,2,5,7,9-15H2,1H3,(H,21,24)
InChIKeyWBAPCVNMJRCFGJ-UHFFFAOYSA-N
XLogP1.76
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide (CID 55501528) is N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide is CCc1ccccc1NC(=O)CN1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is WBAPCVNMJRCFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-2-16-6-3-4-8-18(16)21-19(24)15-22-9-5-7-17(14-22)20(25)23-10-12-26-13-11-23/h3-4,6,8,17H,2,5,7,9-15H2,1H3,(H,21,24).
What are the key properties of N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 359.47 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 55501528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).