N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide

C12H23N3O2 — CID 113402232

IUPACN-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(C(=O)CNC(C)C)CC1
InChIInChI=1S/C12H23N3O2/c1-9(2)13-8-12(17)15-6-4-11(5-7-15)14-10(3)16/h9,11,13H,4-8H2,1-3H3,(H,14,16)
InChIKeyHJZDRCOOJGAMHW-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.11
Rot. Bonds4

About N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide

N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide (PubChem CID 113402232) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide
PubChem CID113402232
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(C(=O)CNC(C)C)CC1
InChIInChI=1S/C12H23N3O2/c1-9(2)13-8-12(17)15-6-4-11(5-7-15)14-10(3)16/h9,11,13H,4-8H2,1-3H3,(H,14,16)
InChIKeyHJZDRCOOJGAMHW-UHFFFAOYSA-N
XLogP0.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide?
The IUPAC name of N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide (CID 113402232) is N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide?
The canonical SMILES for N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide is CC(=O)NC1CCN(C(=O)CNC(C)C)CC1.
What is the InChIKey of N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide?
The InChIKey is HJZDRCOOJGAMHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-9(2)13-8-12(17)15-6-4-11(5-7-15)14-10(3)16/h9,11,13H,4-8H2,1-3H3,(H,14,16).
What are the key properties of N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide?
N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 113402232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).