2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide

C11H21N3O3 — CID 143049112

IUPAC2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide
SMILESCC(=O)NCC(=O)NCC1(O)CCN(C)CC1
InChIInChI=1S/C11H21N3O3/c1-9(15)12-7-10(16)13-8-11(17)3-5-14(2)6-4-11/h17H,3-8H2,1-2H3,(H,12,15)(H,13,16)
InChIKeyZASVLXKUJFLKID-UHFFFAOYSA-N
MW243.31 g/mol
LogP-1.30
Rot. Bonds4

About 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide

2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide (PubChem CID 143049112) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide
PubChem CID143049112
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide
SMILESCC(=O)NCC(=O)NCC1(O)CCN(C)CC1
InChIInChI=1S/C11H21N3O3/c1-9(15)12-7-10(16)13-8-11(17)3-5-14(2)6-4-11/h17H,3-8H2,1-2H3,(H,12,15)(H,13,16)
InChIKeyZASVLXKUJFLKID-UHFFFAOYSA-N
XLogP-1.30
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-1.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
The IUPAC name of 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide (CID 143049112) is 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide.
What is the SMILES notation for 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
The canonical SMILES for 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide is CC(=O)NCC(=O)NCC1(O)CCN(C)CC1.
What is the InChIKey of 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
The InChIKey is ZASVLXKUJFLKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-9(15)12-7-10(16)13-8-11(17)3-5-14(2)6-4-11/h17H,3-8H2,1-2H3,(H,12,15)(H,13,16).
What are the key properties of 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide has a molecular weight of 243.31 g/mol, XLogP of -1.30, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide is sourced from PubChem (CID 143049112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).