2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide

C9H17NO3 — CID 130831737

IUPAC2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide
SMILESCO[C@@H]1CCC[C@H]1NC(=O)C(C)O
InChIInChI=1S/C9H17NO3/c1-6(11)9(12)10-7-4-3-5-8(7)13-2/h6-8,11H,3-5H2,1-2H3,(H,10,12)/t6?,7-,8-/m1/s1
InChIKeyNTIMXSNDIJMIDU-SPDVFEMOSA-N
MW187.24 g/mol
LogP0.05
Rot. Bonds3

About 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide

2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide (PubChem CID 130831737) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide.

Molecular Properties

Compound Name2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide
PubChem CID130831737
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC Name2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide
SMILESCO[C@@H]1CCC[C@H]1NC(=O)C(C)O
InChIInChI=1S/C9H17NO3/c1-6(11)9(12)10-7-4-3-5-8(7)13-2/h6-8,11H,3-5H2,1-2H3,(H,10,12)/t6?,7-,8-/m1/s1
InChIKeyNTIMXSNDIJMIDU-SPDVFEMOSA-N
XLogP0.05
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide?
The IUPAC name of 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide (CID 130831737) is 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide.
What is the SMILES notation for 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide?
The canonical SMILES for 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide is CO[C@@H]1CCC[C@H]1NC(=O)C(C)O.
What is the InChIKey of 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide?
The InChIKey is NTIMXSNDIJMIDU-SPDVFEMOSA-N. The full InChI is InChI=1S/C9H17NO3/c1-6(11)9(12)10-7-4-3-5-8(7)13-2/h6-8,11H,3-5H2,1-2H3,(H,10,12)/t6?,7-,8-/m1/s1.
What are the key properties of 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide?
2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide has a molecular weight of 187.24 g/mol, XLogP of 0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(1R,2R)-2-methoxycyclopentyl]propanamide is sourced from PubChem (CID 130831737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).