N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide

C18H26N4O3 — CID 119840351

IUPACN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide
SMILESO=C(CN1CCC(NC(=O)C2CNCCO2)CC1)Nc1ccccc1
InChIInChI=1S/C18H26N4O3/c23-17(20-14-4-2-1-3-5-14)13-22-9-6-15(7-10-22)21-18(24)16-12-19-8-11-25-16/h1-5,15-16,19H,6-13H2,(H,20,23)(H,21,24)
InChIKeyRESJPHKIYLYDAX-UHFFFAOYSA-N
MW346.43 g/mol
LogP0.19
Rot. Bonds5

About N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide

N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide (PubChem CID 119840351) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide
PubChem CID119840351
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide
SMILESO=C(CN1CCC(NC(=O)C2CNCCO2)CC1)Nc1ccccc1
InChIInChI=1S/C18H26N4O3/c23-17(20-14-4-2-1-3-5-14)13-22-9-6-15(7-10-22)21-18(24)16-12-19-8-11-25-16/h1-5,15-16,19H,6-13H2,(H,20,23)(H,21,24)
InChIKeyRESJPHKIYLYDAX-UHFFFAOYSA-N
XLogP0.19
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 50.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide?
The IUPAC name of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide (CID 119840351) is N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide.
What is the SMILES notation for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide?
The canonical SMILES for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide is O=C(CN1CCC(NC(=O)C2CNCCO2)CC1)Nc1ccccc1.
What is the InChIKey of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide?
The InChIKey is RESJPHKIYLYDAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c23-17(20-14-4-2-1-3-5-14)13-22-9-6-15(7-10-22)21-18(24)16-12-19-8-11-25-16/h1-5,15-16,19H,6-13H2,(H,20,23)(H,21,24).
What are the key properties of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide?
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 0.19, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide is sourced from PubChem (CID 119840351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).