2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide

C16H31N3O2 — CID 65168063

IUPAC2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide
SMILESCCOC1CC(NC2CCN(CC(N)=O)CC2)C1(C)CC
InChIInChI=1S/C16H31N3O2/c1-4-16(3)13(10-14(16)21-5-2)18-12-6-8-19(9-7-12)11-15(17)20/h12-14,18H,4-11H2,1-3H3,(H2,17,20)
InChIKeyOQUKMOOKKOKSGP-UHFFFAOYSA-N
MW297.44 g/mol
LogP1.12
Rot. Bonds7

About 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide

2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide (PubChem CID 65168063) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide
PubChem CID65168063
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC Name2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide
SMILESCCOC1CC(NC2CCN(CC(N)=O)CC2)C1(C)CC
InChIInChI=1S/C16H31N3O2/c1-4-16(3)13(10-14(16)21-5-2)18-12-6-8-19(9-7-12)11-15(17)20/h12-14,18H,4-11H2,1-3H3,(H2,17,20)
InChIKeyOQUKMOOKKOKSGP-UHFFFAOYSA-N
XLogP1.12
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.44
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide (CID 65168063) is 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide is CCOC1CC(NC2CCN(CC(N)=O)CC2)C1(C)CC.
What is the InChIKey of 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide?
The InChIKey is OQUKMOOKKOKSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-4-16(3)13(10-14(16)21-5-2)18-12-6-8-19(9-7-12)11-15(17)20/h12-14,18H,4-11H2,1-3H3,(H2,17,20).
What are the key properties of 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide?
2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide has a molecular weight of 297.44 g/mol, XLogP of 1.12, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 65168063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).