1-(4-methoxyphenyl)-2-piperidin-1-ylethanone

C14H19NO2 — CID 2302912

IUPAC1-(4-methoxyphenyl)-2-piperidin-1-ylethanone
SMILESCOc1ccc(C(=O)CN2CCCCC2)cc1
InChIInChI=1S/C14H19NO2/c1-17-13-7-5-12(6-8-13)14(16)11-15-9-3-2-4-10-15/h5-8H,2-4,9-11H2,1H3
InChIKeyDHVPYLORVFNGLD-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.36
Rot. Bonds4

About 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone

1-(4-methoxyphenyl)-2-piperidin-1-ylethanone (PubChem CID 2302912) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-piperidin-1-ylethanone
PubChem CID2302912
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-(4-methoxyphenyl)-2-piperidin-1-ylethanone
SMILESCOc1ccc(C(=O)CN2CCCCC2)cc1
InChIInChI=1S/C14H19NO2/c1-17-13-7-5-12(6-8-13)14(16)11-15-9-3-2-4-10-15/h5-8H,2-4,9-11H2,1H3
InChIKeyDHVPYLORVFNGLD-UHFFFAOYSA-N
XLogP2.36
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone?
The IUPAC name of 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone (CID 2302912) is 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone?
The canonical SMILES for 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone is COc1ccc(C(=O)CN2CCCCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone?
The InChIKey is DHVPYLORVFNGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-17-13-7-5-12(6-8-13)14(16)11-15-9-3-2-4-10-15/h5-8H,2-4,9-11H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone?
1-(4-methoxyphenyl)-2-piperidin-1-ylethanone has a molecular weight of 233.31 g/mol, XLogP of 2.36, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-piperidin-1-ylethanone is sourced from PubChem (CID 2302912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).