N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide

C11H20N2O4 — CID 58543399

IUPACN-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide
SMILESCC(=O)NC[C@H]1C[C@H](CNC(C)=O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C11H20N2O4/c1-6(14)12-4-8-3-9(5-13-7(2)15)11(17)10(8)16/h8-11,16-17H,3-5H2,1-2H3,(H,12,14)(H,13,15)/t8-,9-,10-,11-/m1/s1
InChIKeyFFIBDPVGOUOIFZ-GWOFURMSSA-N
MW244.29 g/mol
LogP-1.38
Rot. Bonds4

About N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide

N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide (PubChem CID 58543399) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide
PubChem CID58543399
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC NameN-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide
SMILESCC(=O)NC[C@H]1C[C@H](CNC(C)=O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C11H20N2O4/c1-6(14)12-4-8-3-9(5-13-7(2)15)11(17)10(8)16/h8-11,16-17H,3-5H2,1-2H3,(H,12,14)(H,13,15)/t8-,9-,10-,11-/m1/s1
InChIKeyFFIBDPVGOUOIFZ-GWOFURMSSA-N
XLogP-1.38
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-1.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]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-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide?
The IUPAC name of N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide (CID 58543399) is N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide.
What is the SMILES notation for N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide?
The canonical SMILES for N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide is CC(=O)NC[C@H]1C[C@H](CNC(C)=O)[C@@H](O)[C@@H]1O.
What is the InChIKey of N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide?
The InChIKey is FFIBDPVGOUOIFZ-GWOFURMSSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-6(14)12-4-8-3-9(5-13-7(2)15)11(17)10(8)16/h8-11,16-17H,3-5H2,1-2H3,(H,12,14)(H,13,15)/t8-,9-,10-,11-/m1/s1.
What are the key properties of N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide?
N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide has a molecular weight of 244.29 g/mol, XLogP of -1.38, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R,2R,3R,4R)-4-(acetamidomethyl)-2,3-dihydroxycyclopentyl]methyl]acetamide is sourced from PubChem (CID 58543399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).