2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide

C15H27N3O2 — CID 62782565

IUPAC2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide
SMILESNC(=O)CC1CCN(C(=O)CC2CCC(N)CC2)CC1
InChIInChI=1S/C15H27N3O2/c16-13-3-1-11(2-4-13)10-15(20)18-7-5-12(6-8-18)9-14(17)19/h11-13H,1-10,16H2,(H2,17,19)
InChIKeyILHPWSJBFRJPII-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.01
Rot. Bonds4

About 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide

2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide (PubChem CID 62782565) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide
PubChem CID62782565
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide
SMILESNC(=O)CC1CCN(C(=O)CC2CCC(N)CC2)CC1
InChIInChI=1S/C15H27N3O2/c16-13-3-1-11(2-4-13)10-15(20)18-7-5-12(6-8-18)9-14(17)19/h11-13H,1-10,16H2,(H2,17,19)
InChIKeyILHPWSJBFRJPII-UHFFFAOYSA-N
XLogP1.01
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide (CID 62782565) is 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide is NC(=O)CC1CCN(C(=O)CC2CCC(N)CC2)CC1.
What is the InChIKey of 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide?
The InChIKey is ILHPWSJBFRJPII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c16-13-3-1-11(2-4-13)10-15(20)18-7-5-12(6-8-18)9-14(17)19/h11-13H,1-10,16H2,(H2,17,19).
What are the key properties of 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide?
2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide has a molecular weight of 281.40 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(4-aminocyclohexyl)acetyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 62782565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).