N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide

C13H27N3O — CID 60805793

IUPACN-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
SMILESCCC(C)NC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C13H27N3O/c1-4-11(3)15-13(17)10-16(5-2)12-6-8-14-9-7-12/h11-12,14H,4-10H2,1-3H3,(H,15,17)
InChIKeyQIJFJGKOPVDBMU-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.98
Rot. Bonds6

About N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide

N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide (PubChem CID 60805793) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
PubChem CID60805793
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
SMILESCCC(C)NC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C13H27N3O/c1-4-11(3)15-13(17)10-16(5-2)12-6-8-14-9-7-12/h11-12,14H,4-10H2,1-3H3,(H,15,17)
InChIKeyQIJFJGKOPVDBMU-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide 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-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide (CID 60805793) is N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide is CCC(C)NC(=O)CN(CC)C1CCNCC1.
What is the InChIKey of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
The InChIKey is QIJFJGKOPVDBMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-4-11(3)15-13(17)10-16(5-2)12-6-8-14-9-7-12/h11-12,14H,4-10H2,1-3H3,(H,15,17).
What are the key properties of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide has a molecular weight of 241.38 g/mol, XLogP of 0.98, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide is sourced from PubChem (CID 60805793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).