N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide

C10H19NO4 — CID 58543408

IUPACN-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide
SMILESCOC[C@H]1C[C@H](CNC(C)=O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C10H19NO4/c1-6(12)11-4-7-3-8(5-15-2)10(14)9(7)13/h7-10,13-14H,3-5H2,1-2H3,(H,11,12)/t7-,8-,9-,10-/m1/s1
InChIKeyIHYFSFWAOZGFID-ZYUZMQFOSA-N
MW217.26 g/mol
LogP-0.87
Rot. Bonds4

About N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide

N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide (PubChem CID 58543408) has the molecular formula C10H19NO4 and a molecular weight of 217.26 g/mol. Its IUPAC name is N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide
PubChem CID58543408
Molecular FormulaC10H19NO4
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC NameN-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide
SMILESCOC[C@H]1C[C@H](CNC(C)=O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C10H19NO4/c1-6(12)11-4-7-3-8(5-15-2)10(14)9(7)13/h7-10,13-14H,3-5H2,1-2H3,(H,11,12)/t7-,8-,9-,10-/m1/s1
InChIKeyIHYFSFWAOZGFID-ZYUZMQFOSA-N
XLogP-0.87
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 ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide?
The IUPAC name of N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide (CID 58543408) is N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide.
What is the SMILES notation for N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide?
The canonical SMILES for N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide is COC[C@H]1C[C@H](CNC(C)=O)[C@@H](O)[C@@H]1O.
What is the InChIKey of N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide?
The InChIKey is IHYFSFWAOZGFID-ZYUZMQFOSA-N. The full InChI is InChI=1S/C10H19NO4/c1-6(12)11-4-7-3-8(5-15-2)10(14)9(7)13/h7-10,13-14H,3-5H2,1-2H3,(H,11,12)/t7-,8-,9-,10-/m1/s1.
What are the key properties of N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide?
N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide has a molecular weight of 217.26 g/mol, XLogP of -0.87, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R,2R,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]methyl]acetamide is sourced from PubChem (CID 58543408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).