(1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol

C8H13NO2 — CID 95975775

IUPAC(1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol
SMILESC[C@@H](N)C[C@@H](O)c1ccco1
InChIInChI=1S/C8H13NO2/c1-6(9)5-7(10)8-3-2-4-11-8/h2-4,6-7,10H,5,9H2,1H3/t6-,7-/m1/s1
InChIKeyWAFBZZZRVPRDGT-RNFRBKRXSA-N
MW155.20 g/mol
LogP1.05
Rot. Bonds3

About (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol

(1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol (PubChem CID 95975775) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol.

Molecular Properties

Compound Name(1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol
PubChem CID95975775
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name(1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol
SMILESC[C@@H](N)C[C@@H](O)c1ccco1
InChIInChI=1S/C8H13NO2/c1-6(9)5-7(10)8-3-2-4-11-8/h2-4,6-7,10H,5,9H2,1H3/t6-,7-/m1/s1
InChIKeyWAFBZZZRVPRDGT-RNFRBKRXSA-N
XLogP1.05
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 ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,3R)-3-amino-1-(furan-2-yl)butan-1-ol
CID 95975773
(1S,3S)-1-(furan-2-yl)butane-1,3-diol
CID 46177371
1-(furan-2-yl)pentane-1,3,4-triol
CID 175602784
furan;1-(furan-2-yl)-3-methylbutan-1-ol
CID 23208167
acetylene;(1S)-1-(furan-2-yl)propan-1-ol
CID 143788269
3-amino-1-(furan-2-yl)-5-methoxypentan-1-ol
CID 103967416
(2S)-N-[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-2-hydroxy-2-phenylacetamide
CID 99589419
1-(furan-2-yl)-3-methylbutan-1-amine;hydrochloride
CID 86263007
1-(furan-2-yl)-3-methylbut-3-en-1-ol
CID 11457787
N'-[2-(furan-2-yl)-2-hydroxyethyl]ethanimidamide;hydroiodide
CID 130666162
3-chloro-1-(furan-2-yl)propan-1-ol
CID 77242319
(1R)-3-chloro-1-(furan-2-yl)propan-1-ol
CID 67216727

Frequently Asked Questions

What is the IUPAC name of (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol?
The IUPAC name of (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol (CID 95975775) is (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol.
What is the SMILES notation for (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol?
The canonical SMILES for (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol is C[C@@H](N)C[C@@H](O)c1ccco1.
What is the InChIKey of (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol?
The InChIKey is WAFBZZZRVPRDGT-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H13NO2/c1-6(9)5-7(10)8-3-2-4-11-8/h2-4,6-7,10H,5,9H2,1H3/t6-,7-/m1/s1.
What are the key properties of (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol?
(1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol has a molecular weight of 155.20 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3R)-3-amino-1-(furan-2-yl)butan-1-ol is sourced from PubChem (CID 95975775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).