(3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine

C11H17NO2 — CID 131084239

IUPAC(3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine
SMILESCC(N[C@@H]1CCCOC1)c1ccoc1
InChIInChI=1S/C11H17NO2/c1-9(10-4-6-14-7-10)12-11-3-2-5-13-8-11/h4,6-7,9,11-12H,2-3,5,8H2,1H3/t9?,11-/m1/s1
InChIKeyYLZLUUBPQADQAP-HCCKASOXSA-N
MW195.26 g/mol
LogP2.11
Rot. Bonds3

About (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine

(3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine (PubChem CID 131084239) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine.

Molecular Properties

Compound Name(3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine
PubChem CID131084239
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name(3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine
SMILESCC(N[C@@H]1CCCOC1)c1ccoc1
InChIInChI=1S/C11H17NO2/c1-9(10-4-6-14-7-10)12-11-3-2-5-13-8-11/h4,6-7,9,11-12H,2-3,5,8H2,1H3/t9?,11-/m1/s1
InChIKeyYLZLUUBPQADQAP-HCCKASOXSA-N
XLogP2.11
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine?
The IUPAC name of (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine (CID 131084239) is (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine.
What is the SMILES notation for (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine?
The canonical SMILES for (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine is CC(N[C@@H]1CCCOC1)c1ccoc1.
What is the InChIKey of (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine?
The InChIKey is YLZLUUBPQADQAP-HCCKASOXSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9(10-4-6-14-7-10)12-11-3-2-5-13-8-11/h4,6-7,9,11-12H,2-3,5,8H2,1H3/t9?,11-/m1/s1.
What are the key properties of (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine?
(3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine has a molecular weight of 195.26 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[1-(furan-3-yl)ethyl]oxan-3-amine is sourced from PubChem (CID 131084239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).