2-(N-methylanilino)-1-piperidin-1-ylethanone

C14H20N2O — CID 3062765

IUPAC2-(N-methylanilino)-1-piperidin-1-ylethanone
SMILESCN(CC(=O)N1CCCCC1)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-15(13-8-4-2-5-9-13)12-14(17)16-10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-12H2,1H3
InChIKeyZEULBUZDQBZXEN-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.14
Rot. Bonds3

About 2-(N-methylanilino)-1-piperidin-1-ylethanone

2-(N-methylanilino)-1-piperidin-1-ylethanone (PubChem CID 3062765) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(N-methylanilino)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(N-methylanilino)-1-piperidin-1-ylethanone
PubChem CID3062765
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(N-methylanilino)-1-piperidin-1-ylethanone
SMILESCN(CC(=O)N1CCCCC1)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-15(13-8-4-2-5-9-13)12-14(17)16-10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-12H2,1H3
InChIKeyZEULBUZDQBZXEN-UHFFFAOYSA-N
XLogP2.14
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(N-methylanilino)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(N-methylanilino)-1-piperidin-1-ylethanone (CID 3062765) is 2-(N-methylanilino)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(N-methylanilino)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(N-methylanilino)-1-piperidin-1-ylethanone is CN(CC(=O)N1CCCCC1)c1ccccc1.
What is the InChIKey of 2-(N-methylanilino)-1-piperidin-1-ylethanone?
The InChIKey is ZEULBUZDQBZXEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-15(13-8-4-2-5-9-13)12-14(17)16-10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-12H2,1H3.
What are the key properties of 2-(N-methylanilino)-1-piperidin-1-ylethanone?
2-(N-methylanilino)-1-piperidin-1-ylethanone has a molecular weight of 232.33 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-methylanilino)-1-piperidin-1-ylethanone is sourced from PubChem (CID 3062765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).