N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine

C9H13NO2 — CID 81403066

IUPACN-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
SMILESC[C@@H](NC1COC1)c1ccco1
InChIInChI=1S/C9H13NO2/c1-7(9-3-2-4-12-9)10-8-5-11-6-8/h2-4,7-8,10H,5-6H2,1H3/t7-/m1/s1
InChIKeyAKOGWTIUEVSEKZ-SSDOTTSWSA-N
MW167.21 g/mol
LogP1.33
Rot. Bonds3

About N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine

N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine (PubChem CID 81403066) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine.

Molecular Properties

Compound NameN-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
PubChem CID81403066
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC NameN-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
SMILESC[C@@H](NC1COC1)c1ccco1
InChIInChI=1S/C9H13NO2/c1-7(9-3-2-4-12-9)10-8-5-11-6-8/h2-4,7-8,10H,5-6H2,1H3/t7-/m1/s1
InChIKeyAKOGWTIUEVSEKZ-SSDOTTSWSA-N
XLogP1.33
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-(furan-2-yl)ethyl]oxan-3-amine
CID 81402561
N-[(1S)-1-(furan-2-yl)ethyl]-1-methylpiperidin-4-amine
CID 81403796
N-[1-(furan-2-yl)ethyl]thiolan-3-amine
CID 43400292
N-[(1S)-1-(furan-2-yl)ethyl]-5-oxaspiro[3.5]nonan-8-amine
CID 81399877
N-[1-(furan-2-yl)ethyl]-1-oxaspiro[5.5]undecan-4-amine
CID 79894899
N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine
CID 114817252
N-[1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 43730440
N-[(1R)-1-(furan-2-yl)ethyl]-5-methylthiolan-3-amine
CID 81402631
N-[(1S)-1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 81402923
N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine
CID 81403874
N-[(1R)-1-(furan-2-yl)ethyl]-1,1-dioxothiolan-3-amine
CID 81402788
N-[(1S)-1-(furan-2-yl)ethyl]azepan-4-amine
CID 103982613

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine?
The IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine (CID 81403066) is N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine.
What is the SMILES notation for N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine?
The canonical SMILES for N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine is C[C@@H](NC1COC1)c1ccco1.
What is the InChIKey of N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine?
The InChIKey is AKOGWTIUEVSEKZ-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H13NO2/c1-7(9-3-2-4-12-9)10-8-5-11-6-8/h2-4,7-8,10H,5-6H2,1H3/t7-/m1/s1.
What are the key properties of N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine?
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine has a molecular weight of 167.21 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine is sourced from PubChem (CID 81403066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).