1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one

C16H25NO2 — CID 19099562

IUPAC1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one
SMILESCC1CCN(C)C(C)C1(C)CCC(=O)c1ccoc1
InChIInChI=1S/C16H25NO2/c1-12-6-9-17(4)13(2)16(12,3)8-5-15(18)14-7-10-19-11-14/h7,10-13H,5-6,8-9H2,1-4H3
InChIKeyNYLIGJINQCSLEC-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.61
Rot. Bonds4

About 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one

1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one (PubChem CID 19099562) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one.

Molecular Properties

Compound Name1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one
PubChem CID19099562
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one
SMILESCC1CCN(C)C(C)C1(C)CCC(=O)c1ccoc1
InChIInChI=1S/C16H25NO2/c1-12-6-9-17(4)13(2)16(12,3)8-5-15(18)14-7-10-19-11-14/h7,10-13H,5-6,8-9H2,1-4H3
InChIKeyNYLIGJINQCSLEC-UHFFFAOYSA-N
XLogP3.61
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one?
The IUPAC name of 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one (CID 19099562) is 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one.
What is the SMILES notation for 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one?
The canonical SMILES for 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one is CC1CCN(C)C(C)C1(C)CCC(=O)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one?
The InChIKey is NYLIGJINQCSLEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12-6-9-17(4)13(2)16(12,3)8-5-15(18)14-7-10-19-11-14/h7,10-13H,5-6,8-9H2,1-4H3.
What are the key properties of 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one?
1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one has a molecular weight of 263.38 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-3-(1,2,3,4-tetramethylpiperidin-3-yl)propan-1-one is sourced from PubChem (CID 19099562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).