5-[(1S)-1-aminopropyl]furan-2-ol

C7H11NO2 — CID 130706331

IUPAC5-[(1S)-1-aminopropyl]furan-2-ol
SMILESCC[C@H](N)c1ccc(O)o1
InChIInChI=1S/C7H11NO2/c1-2-5(8)6-3-4-7(9)10-6/h3-5,9H,2,8H2,1H3/t5-/m0/s1
InChIKeyKTIAEMYNJJGSRP-YFKPBYRVSA-N
MW141.17 g/mol
LogP1.39
Rot. Bonds2

About 5-[(1S)-1-aminopropyl]furan-2-ol

5-[(1S)-1-aminopropyl]furan-2-ol (PubChem CID 130706331) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is 5-[(1S)-1-aminopropyl]furan-2-ol.

Molecular Properties

Compound Name5-[(1S)-1-aminopropyl]furan-2-ol
PubChem CID130706331
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name5-[(1S)-1-aminopropyl]furan-2-ol
SMILESCC[C@H](N)c1ccc(O)o1
InChIInChI=1S/C7H11NO2/c1-2-5(8)6-3-4-7(9)10-6/h3-5,9H,2,8H2,1H3/t5-/m0/s1
InChIKeyKTIAEMYNJJGSRP-YFKPBYRVSA-N
XLogP1.39
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(1S)-1-aminopropyl]furan-2-ol?
The IUPAC name of 5-[(1S)-1-aminopropyl]furan-2-ol (CID 130706331) is 5-[(1S)-1-aminopropyl]furan-2-ol.
What is the SMILES notation for 5-[(1S)-1-aminopropyl]furan-2-ol?
The canonical SMILES for 5-[(1S)-1-aminopropyl]furan-2-ol is CC[C@H](N)c1ccc(O)o1.
What is the InChIKey of 5-[(1S)-1-aminopropyl]furan-2-ol?
The InChIKey is KTIAEMYNJJGSRP-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H11NO2/c1-2-5(8)6-3-4-7(9)10-6/h3-5,9H,2,8H2,1H3/t5-/m0/s1.
What are the key properties of 5-[(1S)-1-aminopropyl]furan-2-ol?
5-[(1S)-1-aminopropyl]furan-2-ol has a molecular weight of 141.17 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1S)-1-aminopropyl]furan-2-ol is sourced from PubChem (CID 130706331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).