2-(methylamino)-1-piperidin-1-ylethanone

C8H16N2O — CID 7330590

IUPAC2-(methylamino)-1-piperidin-1-ylethanone
SMILESCNCC(=O)N1CCCCC1
InChIInChI=1S/C8H16N2O/c1-9-7-8(11)10-5-3-2-4-6-10/h9H,2-7H2,1H3
InChIKeyPYBDYFQWBAYWHD-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.22
Rot. Bonds2

About 2-(methylamino)-1-piperidin-1-ylethanone

2-(methylamino)-1-piperidin-1-ylethanone (PubChem CID 7330590) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-(methylamino)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(methylamino)-1-piperidin-1-ylethanone
PubChem CID7330590
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-(methylamino)-1-piperidin-1-ylethanone
SMILESCNCC(=O)N1CCCCC1
InChIInChI=1S/C8H16N2O/c1-9-7-8(11)10-5-3-2-4-6-10/h9H,2-7H2,1H3
InChIKeyPYBDYFQWBAYWHD-UHFFFAOYSA-N
XLogP0.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(methylamino)-1-piperidin-1-ylethanone (CID 7330590) is 2-(methylamino)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(methylamino)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(methylamino)-1-piperidin-1-ylethanone is CNCC(=O)N1CCCCC1.
What is the InChIKey of 2-(methylamino)-1-piperidin-1-ylethanone?
The InChIKey is PYBDYFQWBAYWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-9-7-8(11)10-5-3-2-4-6-10/h9H,2-7H2,1H3.
What are the key properties of 2-(methylamino)-1-piperidin-1-ylethanone?
2-(methylamino)-1-piperidin-1-ylethanone has a molecular weight of 156.23 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-1-piperidin-1-ylethanone is sourced from PubChem (CID 7330590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).