2-[2-amino-3-(furan-2-yl)propoxy]phenol

C13H15NO3 — CID 117246117

IUPAC2-[2-amino-3-(furan-2-yl)propoxy]phenol
SMILESNC(COc1ccccc1O)Cc1ccco1
InChIInChI=1S/C13H15NO3/c14-10(8-11-4-3-7-16-11)9-17-13-6-2-1-5-12(13)15/h1-7,10,15H,8-9,14H2
InChIKeyRKPGKUFMCPMJBW-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.93
Rot. Bonds5

About 2-[2-amino-3-(furan-2-yl)propoxy]phenol

2-[2-amino-3-(furan-2-yl)propoxy]phenol (PubChem CID 117246117) has the molecular formula C13H15NO3 and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-[2-amino-3-(furan-2-yl)propoxy]phenol.

Molecular Properties

Compound Name2-[2-amino-3-(furan-2-yl)propoxy]phenol
PubChem CID117246117
Molecular FormulaC13H15NO3
Molecular Weight233.27 g/mol
Exact Mass233.11
IUPAC Name2-[2-amino-3-(furan-2-yl)propoxy]phenol
SMILESNC(COc1ccccc1O)Cc1ccco1
InChIInChI=1S/C13H15NO3/c14-10(8-11-4-3-7-16-11)9-17-13-6-2-1-5-12(13)15/h1-7,10,15H,8-9,14H2
InChIKeyRKPGKUFMCPMJBW-UHFFFAOYSA-N
XLogP1.93
TPSA68.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-amino-4,4-dimethylpentoxy)phenol
CID 117241706
1,4-bis(furan-2-yl)butan-2-amine
CID 105177346
(3S)-3-amino-4-(furan-2-yl)butanoic acid
CID 2761693
1-(furan-2-yl)-4-methylsulfanylbutan-2-amine
CID 105177500
1-(furan-2-yl)pent-4-en-2-amine
CID 116660416
1-(2-fluorophenyl)sulfanyl-3-(furan-2-yl)propan-2-amine
CID 83175961
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
2-(2-ethoxyphenyl)-3-(furan-2-yl)propan-1-amine
CID 83974434
1-butan-2-ylsulfanyl-3-(furan-2-yl)propan-2-amine
CID 83175444
2-amino-3-(2-prop-2-enoxyphenoxy)propan-1-ol
CID 23337701
1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine
CID 103169378
5-ethoxy-1-(furan-2-yl)pentan-2-amine
CID 105177455

Frequently Asked Questions

What is the IUPAC name of 2-[2-amino-3-(furan-2-yl)propoxy]phenol?
The IUPAC name of 2-[2-amino-3-(furan-2-yl)propoxy]phenol (CID 117246117) is 2-[2-amino-3-(furan-2-yl)propoxy]phenol.
What is the SMILES notation for 2-[2-amino-3-(furan-2-yl)propoxy]phenol?
The canonical SMILES for 2-[2-amino-3-(furan-2-yl)propoxy]phenol is NC(COc1ccccc1O)Cc1ccco1.
What is the InChIKey of 2-[2-amino-3-(furan-2-yl)propoxy]phenol?
The InChIKey is RKPGKUFMCPMJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3/c14-10(8-11-4-3-7-16-11)9-17-13-6-2-1-5-12(13)15/h1-7,10,15H,8-9,14H2.
What are the key properties of 2-[2-amino-3-(furan-2-yl)propoxy]phenol?
2-[2-amino-3-(furan-2-yl)propoxy]phenol has a molecular weight of 233.27 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-amino-3-(furan-2-yl)propoxy]phenol is sourced from PubChem (CID 117246117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).