N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide

C15H26N2O3Si — CID 166375841

IUPACN-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide
SMILESCN1CCC(O)(CNC(=O)c2ccoc2[Si](C)(C)C)CC1
InChIInChI=1S/C15H26N2O3Si/c1-17-8-6-15(19,7-9-17)11-16-13(18)12-5-10-20-14(12)21(2,3)4/h5,10,19H,6-9,11H2,1-4H3,(H,16,18)
InChIKeyMHKGQDUHTBVXNM-UHFFFAOYSA-N
MW310.47 g/mol
LogP1.01
Rot. Bonds4

About N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide

N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide (PubChem CID 166375841) has the molecular formula C15H26N2O3Si and a molecular weight of 310.47 g/mol. Its IUPAC name is N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide
PubChem CID166375841
Molecular FormulaC15H26N2O3Si
Molecular Weight310.47 g/mol
Exact Mass310.17
IUPAC NameN-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide
SMILESCN1CCC(O)(CNC(=O)c2ccoc2[Si](C)(C)C)CC1
InChIInChI=1S/C15H26N2O3Si/c1-17-8-6-15(19,7-9-17)11-16-13(18)12-5-10-20-14(12)21(2,3)4/h5,10,19H,6-9,11H2,1-4H3,(H,16,18)
InChIKeyMHKGQDUHTBVXNM-UHFFFAOYSA-N
XLogP1.01
TPSA65.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide?
The IUPAC name of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide (CID 166375841) is N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide.
What is the SMILES notation for N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide?
The canonical SMILES for N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide is CN1CCC(O)(CNC(=O)c2ccoc2[Si](C)(C)C)CC1.
What is the InChIKey of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide?
The InChIKey is MHKGQDUHTBVXNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3Si/c1-17-8-6-15(19,7-9-17)11-16-13(18)12-5-10-20-14(12)21(2,3)4/h5,10,19H,6-9,11H2,1-4H3,(H,16,18).
What are the key properties of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide?
N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide has a molecular weight of 310.47 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-2-trimethylsilylfuran-3-carboxamide is sourced from PubChem (CID 166375841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).