N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide

C17H24N2O4 — CID 166355098

IUPACN-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide
SMILESCC(=O)NC1CC(C2CCN(C(=O)c3oc(CO)cc3C)C2)C1
InChIInChI=1S/C17H24N2O4/c1-10-5-15(9-20)23-16(10)17(22)19-4-3-12(8-19)13-6-14(7-13)18-11(2)21/h5,12-14,20H,3-4,6-9H2,1-2H3,(H,18,21)
InChIKeySZWUBXWVEYOBMR-UHFFFAOYSA-N
MW320.39 g/mol
LogP1.46
Rot. Bonds4

About N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide

N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide (PubChem CID 166355098) has the molecular formula C17H24N2O4 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide
PubChem CID166355098
Molecular FormulaC17H24N2O4
Molecular Weight320.39 g/mol
Exact Mass320.17
IUPAC NameN-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide
SMILESCC(=O)NC1CC(C2CCN(C(=O)c3oc(CO)cc3C)C2)C1
InChIInChI=1S/C17H24N2O4/c1-10-5-15(9-20)23-16(10)17(22)19-4-3-12(8-19)13-6-14(7-13)18-11(2)21/h5,12-14,20H,3-4,6-9H2,1-2H3,(H,18,21)
InChIKeySZWUBXWVEYOBMR-UHFFFAOYSA-N
XLogP1.46
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide 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 N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide?
The IUPAC name of N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide (CID 166355098) is N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide.
What is the SMILES notation for N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide?
The canonical SMILES for N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide is CC(=O)NC1CC(C2CCN(C(=O)c3oc(CO)cc3C)C2)C1.
What is the InChIKey of N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide?
The InChIKey is SZWUBXWVEYOBMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O4/c1-10-5-15(9-20)23-16(10)17(22)19-4-3-12(8-19)13-6-14(7-13)18-11(2)21/h5,12-14,20H,3-4,6-9H2,1-2H3,(H,18,21).
What are the key properties of N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide?
N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide has a molecular weight of 320.39 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide is sourced from PubChem (CID 166355098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).