3-amino-1-(furan-3-yl)propan-1-ol

C7H11NO2 — CID 65184704

IUPAC3-amino-1-(furan-3-yl)propan-1-ol
SMILESNCCC(O)c1ccoc1
InChIInChI=1S/C7H11NO2/c8-3-1-7(9)6-2-4-10-5-6/h2,4-5,7,9H,1,3,8H2
InChIKeyOARTUIJAOPOUKN-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.66
Rot. Bonds3

About 3-amino-1-(furan-3-yl)propan-1-ol

3-amino-1-(furan-3-yl)propan-1-ol (PubChem CID 65184704) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is 3-amino-1-(furan-3-yl)propan-1-ol.

Molecular Properties

Compound Name3-amino-1-(furan-3-yl)propan-1-ol
PubChem CID65184704
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name3-amino-1-(furan-3-yl)propan-1-ol
SMILESNCCC(O)c1ccoc1
InChIInChI=1S/C7H11NO2/c8-3-1-7(9)6-2-4-10-5-6/h2,4-5,7,9H,1,3,8H2
InChIKeyOARTUIJAOPOUKN-UHFFFAOYSA-N
XLogP0.66
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(furan-3-yl)propan-1-ol?
The IUPAC name of 3-amino-1-(furan-3-yl)propan-1-ol (CID 65184704) is 3-amino-1-(furan-3-yl)propan-1-ol.
What is the SMILES notation for 3-amino-1-(furan-3-yl)propan-1-ol?
The canonical SMILES for 3-amino-1-(furan-3-yl)propan-1-ol is NCCC(O)c1ccoc1.
What is the InChIKey of 3-amino-1-(furan-3-yl)propan-1-ol?
The InChIKey is OARTUIJAOPOUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c8-3-1-7(9)6-2-4-10-5-6/h2,4-5,7,9H,1,3,8H2.
What are the key properties of 3-amino-1-(furan-3-yl)propan-1-ol?
3-amino-1-(furan-3-yl)propan-1-ol has a molecular weight of 141.17 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(furan-3-yl)propan-1-ol is sourced from PubChem (CID 65184704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).