(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol

C10H16N2O2 — CID 131175689

IUPAC(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol
SMILESCC(N[C@@H]1CNC[C@H]1O)c1ccco1
InChIInChI=1S/C10H16N2O2/c1-7(10-3-2-4-14-10)12-8-5-11-6-9(8)13/h2-4,7-9,11-13H,5-6H2,1H3/t7?,8-,9-/m1/s1
InChIKeyOLWWKVBUEJKHLX-CFCGPWAMSA-N
MW196.25 g/mol
LogP0.26
Rot. Bonds3

About (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol

(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol (PubChem CID 131175689) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol.

Molecular Properties

Compound Name(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol
PubChem CID131175689
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol
SMILESCC(N[C@@H]1CNC[C@H]1O)c1ccco1
InChIInChI=1S/C10H16N2O2/c1-7(10-3-2-4-14-10)12-8-5-11-6-9(8)13/h2-4,7-9,11-13H,5-6H2,1H3/t7?,8-,9-/m1/s1
InChIKeyOLWWKVBUEJKHLX-CFCGPWAMSA-N
XLogP0.26
TPSA57.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1S,2S)-2-[[(1S)-1-(furan-2-yl)ethyl]amino]cyclopentan-1-ol
CID 102733843
2-[[(1S)-1-(furan-2-yl)ethyl]amino]cycloheptan-1-ol
CID 81399364
N-[(1S)-1-(furan-2-yl)ethyl]-2-methyloxolan-3-amine
CID 82718277
N-[1-(furan-2-yl)ethyl]-2-methylsulfanylcyclopentan-1-amine
CID 103786666
N-[(1S)-1-(furan-2-yl)ethyl]azepan-4-amine
CID 103982613
2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine
CID 81403207
2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine
CID 81403374
2-(azetidin-3-yl)-N-[1-(furan-2-yl)ethyl]propanamide
CID 116674875
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
CID 81403066
N-[(1R)-1-(furan-2-yl)ethyl]-2-methylsulfonylcyclopentan-1-amine
CID 81403412
N-[(1S)-1-(furan-2-yl)ethyl]-4-methylpyrrolidine-3-carboxamide
CID 81400915
2-(azetidin-3-yl)-N-[(1S)-1-(furan-2-yl)ethyl]acetamide
CID 81399568

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol?
The IUPAC name of (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol (CID 131175689) is (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol.
What is the SMILES notation for (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol?
The canonical SMILES for (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol is CC(N[C@@H]1CNC[C@H]1O)c1ccco1.
What is the InChIKey of (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol?
The InChIKey is OLWWKVBUEJKHLX-CFCGPWAMSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(10-3-2-4-14-10)12-8-5-11-6-9(8)13/h2-4,7-9,11-13H,5-6H2,1H3/t7?,8-,9-/m1/s1.
What are the key properties of (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol?
(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol has a molecular weight of 196.25 g/mol, XLogP of 0.26, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol is sourced from PubChem (CID 131175689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).