N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide

C10H19NO4 — CID 75368071

IUPACN-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide
SMILESCOCC1(CNC(C)=O)C[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C10H19NO4/c1-7(12)11-5-10(6-15-2)3-8(13)9(14)4-10/h8-9,13-14H,3-6H2,1-2H3,(H,11,12)/t8-,9+,10?
InChIKeyBLEBVHGADGSIES-ULKQDVFKSA-N
MW217.26 g/mol
LogP-0.73
Rot. Bonds4

About N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide

N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide (PubChem CID 75368071) has the molecular formula C10H19NO4 and a molecular weight of 217.26 g/mol. Its IUPAC name is N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide
PubChem CID75368071
Molecular FormulaC10H19NO4
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC NameN-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide
SMILESCOCC1(CNC(C)=O)C[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C10H19NO4/c1-7(12)11-5-10(6-15-2)3-8(13)9(14)4-10/h8-9,13-14H,3-6H2,1-2H3,(H,11,12)/t8-,9+,10?
InChIKeyBLEBVHGADGSIES-ULKQDVFKSA-N
XLogP-0.73
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 5-0.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]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-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide?
The IUPAC name of N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide (CID 75368071) is N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide.
What is the SMILES notation for N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide?
The canonical SMILES for N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide is COCC1(CNC(C)=O)C[C@@H](O)[C@@H](O)C1.
What is the InChIKey of N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide?
The InChIKey is BLEBVHGADGSIES-ULKQDVFKSA-N. The full InChI is InChI=1S/C10H19NO4/c1-7(12)11-5-10(6-15-2)3-8(13)9(14)4-10/h8-9,13-14H,3-6H2,1-2H3,(H,11,12)/t8-,9+,10?.
What are the key properties of N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide?
N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide has a molecular weight of 217.26 g/mol, XLogP of -0.73, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3S,4R)-3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]acetamide is sourced from PubChem (CID 75368071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).