3-amino-2-(5-methylfuran-2-yl)propan-1-ol

C8H13NO2 — CID 83682054

IUPAC3-amino-2-(5-methylfuran-2-yl)propan-1-ol
SMILESCc1ccc(C(CN)CO)o1
InChIInChI=1S/C8H13NO2/c1-6-2-3-8(11-6)7(4-9)5-10/h2-3,7,10H,4-5,9H2,1H3
InChIKeyFFDCWKBUSDHXHT-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.62
Rot. Bonds3

About 3-amino-2-(5-methylfuran-2-yl)propan-1-ol

3-amino-2-(5-methylfuran-2-yl)propan-1-ol (PubChem CID 83682054) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 3-amino-2-(5-methylfuran-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-amino-2-(5-methylfuran-2-yl)propan-1-ol
PubChem CID83682054
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name3-amino-2-(5-methylfuran-2-yl)propan-1-ol
SMILESCc1ccc(C(CN)CO)o1
InChIInChI=1S/C8H13NO2/c1-6-2-3-8(11-6)7(4-9)5-10/h2-3,7,10H,4-5,9H2,1H3
InChIKeyFFDCWKBUSDHXHT-UHFFFAOYSA-N
XLogP0.62
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-2-(5-methylfuran-2-yl)propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(5-methylfuran-2-yl)butan-1-ol
CID 58330576
methyl 4-amino-3-(5-methylfuran-2-yl)butanoate
CID 66099339
2-(5-methylfuran-2-yl)-3-(2-methylphenoxy)propan-1-ol
CID 117240483
1-(5-methylfuran-2-yl)propan-1-ol
CID 14570731
3-(2-chlorophenoxy)-2-(5-methylfuran-2-yl)propan-1-amine
CID 117240499
2-amino-3-(dimethylamino)-3-(5-methylfuran-2-yl)propan-1-ol
CID 116911635
2-amino-3-(methylamino)-3-(5-methylfuran-2-yl)propan-1-ol
CID 116957574
(1S)-2-fluoro-1-(5-methylfuran-2-yl)ethanamine;hydrochloride
CID 171212357
4-amino-1-(5-methylfuran-2-yl)butan-1-ol
CID 82412823
3-[2-amino-1-(5-methylfuran-2-yl)ethyl]sulfanylbutan-1-ol
CID 66103474
2,5-dimethylfuran;ethanol
CID 160667580
(3R)-3-amino-2,2-difluoro-3-(5-methylfuran-2-yl)propan-1-ol
CID 130649581

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(5-methylfuran-2-yl)propan-1-ol?
The IUPAC name of 3-amino-2-(5-methylfuran-2-yl)propan-1-ol (CID 83682054) is 3-amino-2-(5-methylfuran-2-yl)propan-1-ol.
What is the SMILES notation for 3-amino-2-(5-methylfuran-2-yl)propan-1-ol?
The canonical SMILES for 3-amino-2-(5-methylfuran-2-yl)propan-1-ol is Cc1ccc(C(CN)CO)o1.
What is the InChIKey of 3-amino-2-(5-methylfuran-2-yl)propan-1-ol?
The InChIKey is FFDCWKBUSDHXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-6-2-3-8(11-6)7(4-9)5-10/h2-3,7,10H,4-5,9H2,1H3.
What are the key properties of 3-amino-2-(5-methylfuran-2-yl)propan-1-ol?
3-amino-2-(5-methylfuran-2-yl)propan-1-ol has a molecular weight of 155.20 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(5-methylfuran-2-yl)propan-1-ol is sourced from PubChem (CID 83682054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).