N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide

C8H15NO2 — CID 100990326

IUPACN-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide
SMILESCC(=O)NC[C@@H]1CCC[C@@H]1O
InChIInChI=1S/C8H15NO2/c1-6(10)9-5-7-3-2-4-8(7)11/h7-8,11H,2-5H2,1H3,(H,9,10)/t7-,8-/m0/s1
InChIKeyLXIVAJSDNHPQAG-YUMQZZPRSA-N
MW157.21 g/mol
LogP0.28
Rot. Bonds2

About N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide

N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide (PubChem CID 100990326) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide
PubChem CID100990326
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide
SMILESCC(=O)NC[C@@H]1CCC[C@@H]1O
InChIInChI=1S/C8H15NO2/c1-6(10)9-5-7-3-2-4-8(7)11/h7-8,11H,2-5H2,1H3,(H,9,10)/t7-,8-/m0/s1
InChIKeyLXIVAJSDNHPQAG-YUMQZZPRSA-N
XLogP0.28
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide?
The IUPAC name of N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide (CID 100990326) is N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide.
What is the SMILES notation for N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide?
The canonical SMILES for N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide is CC(=O)NC[C@@H]1CCC[C@@H]1O.
What is the InChIKey of N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide?
The InChIKey is LXIVAJSDNHPQAG-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6(10)9-5-7-3-2-4-8(7)11/h7-8,11H,2-5H2,1H3,(H,9,10)/t7-,8-/m0/s1.
What are the key properties of N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide?
N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide has a molecular weight of 157.21 g/mol, XLogP of 0.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]acetamide is sourced from PubChem (CID 100990326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).