trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide

C6H11NO2 — CID 55282135

IUPACtrans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide
SMILESNC(=O)[C@H]1CCC[C@@H]1O
InChIInChI=1S/C6H11NO2/c7-6(9)4-2-1-3-5(4)8/h4-5,8H,1-3H2,(H2,7,9)/t4-,5-/m0/s1
InChIKeyXLPNKXDLOYEHIM-WHFBIAKZSA-N
MW129.16 g/mol
LogP-0.37
Rot. Bonds1

About trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide

trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide (PubChem CID 55282135) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound Nametrans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide
PubChem CID55282135
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Nametrans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide
SMILESNC(=O)[C@H]1CCC[C@@H]1O
InChIInChI=1S/C6H11NO2/c7-6(9)4-2-1-3-5(4)8/h4-5,8H,1-3H2,(H2,7,9)/t4-,5-/m0/s1
InChIKeyXLPNKXDLOYEHIM-WHFBIAKZSA-N
XLogP-0.37
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide (CID 55282135) is trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide is NC(=O)[C@H]1CCC[C@@H]1O.
What is the InChIKey of trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is XLPNKXDLOYEHIM-WHFBIAKZSA-N. The full InChI is InChI=1S/C6H11NO2/c7-6(9)4-2-1-3-5(4)8/h4-5,8H,1-3H2,(H2,7,9)/t4-,5-/m0/s1.
What are the key properties of trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide?
trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 129.16 g/mol, XLogP of -0.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 55282135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).