2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide

C7H13NO3 — CID 130626161

IUPAC2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide
SMILESO=C(CO)N[C@H]1CC[C@@H](O)C1
InChIInChI=1S/C7H13NO3/c9-4-7(11)8-5-1-2-6(10)3-5/h5-6,9-10H,1-4H2,(H,8,11)/t5-,6+/m0/s1
InChIKeyJWPKIBJRUUWJHV-NTSWFWBYSA-N
MW159.18 g/mol
LogP-0.99
Rot. Bonds2

About 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide

2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide (PubChem CID 130626161) has the molecular formula C7H13NO3 and a molecular weight of 159.18 g/mol. Its IUPAC name is 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide
PubChem CID130626161
Molecular FormulaC7H13NO3
Molecular Weight159.18 g/mol
Exact Mass159.09
IUPAC Name2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide
SMILESO=C(CO)N[C@H]1CC[C@@H](O)C1
InChIInChI=1S/C7H13NO3/c9-4-7(11)8-5-1-2-6(10)3-5/h5-6,9-10H,1-4H2,(H,8,11)/t5-,6+/m0/s1
InChIKeyJWPKIBJRUUWJHV-NTSWFWBYSA-N
XLogP-0.99
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.18
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide?
The IUPAC name of 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide (CID 130626161) is 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide.
What is the SMILES notation for 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide?
The canonical SMILES for 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide is O=C(CO)N[C@H]1CC[C@@H](O)C1.
What is the InChIKey of 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide?
The InChIKey is JWPKIBJRUUWJHV-NTSWFWBYSA-N. The full InChI is InChI=1S/C7H13NO3/c9-4-7(11)8-5-1-2-6(10)3-5/h5-6,9-10H,1-4H2,(H,8,11)/t5-,6+/m0/s1.
What are the key properties of 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide?
2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide has a molecular weight of 159.18 g/mol, XLogP of -0.99, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(1S,3R)-3-hydroxycyclopentyl]acetamide is sourced from PubChem (CID 130626161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).