4-(1-aminoethyl)furan-2-ol

C6H9NO2 — CID 130000619

IUPAC4-(1-aminoethyl)furan-2-ol
SMILESCC(N)c1coc(O)c1
InChIInChI=1S/C6H9NO2/c1-4(7)5-2-6(8)9-3-5/h2-4,8H,7H2,1H3
InChIKeyRBUIYKFOFSGCPN-UHFFFAOYSA-N
MW127.14 g/mol
LogP1.00
Rot. Bonds1

About 4-(1-aminoethyl)furan-2-ol

4-(1-aminoethyl)furan-2-ol (PubChem CID 130000619) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is 4-(1-aminoethyl)furan-2-ol.

Molecular Properties

Compound Name4-(1-aminoethyl)furan-2-ol
PubChem CID130000619
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC Name4-(1-aminoethyl)furan-2-ol
SMILESCC(N)c1coc(O)c1
InChIInChI=1S/C6H9NO2/c1-4(7)5-2-6(8)9-3-5/h2-4,8H,7H2,1H3
InChIKeyRBUIYKFOFSGCPN-UHFFFAOYSA-N
XLogP1.00
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-aminoethyl)benzene-1,2,3-triol
CID 55295720
4-[(1R)-1-aminoethyl]-2-bromophenol
CID 78938003
furan-2,4-diol
CID 69334491
(1S)-1-(4-propan-2-ylfuran-2-yl)propan-1-amine
CID 124653595
3-(1-aminoethyl)-1-benzofuran-5-ol;hydrochloride
CID 46741355
4-[(1R)-1-aminoethyl]phenol;hydrochloride
CID 127264624
1-(3,4,5-tribromophenyl)ethanamine
CID 130135537
2-amino-5-[(1R)-1-aminoethyl]phenol
CID 55297300
3-amino-5-(1-aminoethyl)benzene-1,2-diol
CID 130060617
4-[(1R)-1-aminoethyl]-2-methylphenol
CID 59272894
1-(5-methylfuran-3-yl)ethanol
CID 112692743
benzene-1,2-diol;1-phenylethanamine
CID 174442381

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminoethyl)furan-2-ol?
The IUPAC name of 4-(1-aminoethyl)furan-2-ol (CID 130000619) is 4-(1-aminoethyl)furan-2-ol.
What is the SMILES notation for 4-(1-aminoethyl)furan-2-ol?
The canonical SMILES for 4-(1-aminoethyl)furan-2-ol is CC(N)c1coc(O)c1.
What is the InChIKey of 4-(1-aminoethyl)furan-2-ol?
The InChIKey is RBUIYKFOFSGCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2/c1-4(7)5-2-6(8)9-3-5/h2-4,8H,7H2,1H3.
What are the key properties of 4-(1-aminoethyl)furan-2-ol?
4-(1-aminoethyl)furan-2-ol has a molecular weight of 127.14 g/mol, XLogP of 1.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminoethyl)furan-2-ol is sourced from PubChem (CID 130000619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).