N-(piperidin-3-ylmethyl)acetamide

C8H16N2O — CID 4712037

IUPACN-(piperidin-3-ylmethyl)acetamide
SMILESCC(=O)NCC1CCCNC1
InChIInChI=1S/C8H16N2O/c1-7(11)10-6-8-3-2-4-9-5-8/h8-9H,2-6H2,1H3,(H,10,11)
InChIKeyTXZBOHMPGYOABD-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.12
Rot. Bonds2

About N-(piperidin-3-ylmethyl)acetamide

N-(piperidin-3-ylmethyl)acetamide (PubChem CID 4712037) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)acetamide
PubChem CID4712037
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-(piperidin-3-ylmethyl)acetamide
SMILESCC(=O)NCC1CCCNC1
InChIInChI=1S/C8H16N2O/c1-7(11)10-6-8-3-2-4-9-5-8/h8-9H,2-6H2,1H3,(H,10,11)
InChIKeyTXZBOHMPGYOABD-UHFFFAOYSA-N
XLogP0.12
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)acetamide?
The IUPAC name of N-(piperidin-3-ylmethyl)acetamide (CID 4712037) is N-(piperidin-3-ylmethyl)acetamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)acetamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)acetamide is CC(=O)NCC1CCCNC1.
What is the InChIKey of N-(piperidin-3-ylmethyl)acetamide?
The InChIKey is TXZBOHMPGYOABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7(11)10-6-8-3-2-4-9-5-8/h8-9H,2-6H2,1H3,(H,10,11).
What are the key properties of N-(piperidin-3-ylmethyl)acetamide?
N-(piperidin-3-ylmethyl)acetamide has a molecular weight of 156.23 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)acetamide is sourced from PubChem (CID 4712037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).