[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine

C9H13NO3 — CID 102608146

IUPAC[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine
SMILESNCc1coc(COC2COC2)c1
InChIInChI=1S/C9H13NO3/c10-2-7-1-8(12-3-7)6-13-9-4-11-5-9/h1,3,9H,2,4-6,10H2
InChIKeyYSUSKYAPFSLWSZ-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.65
Rot. Bonds4

About [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine

[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine (PubChem CID 102608146) has the molecular formula C9H13NO3 and a molecular weight of 183.21 g/mol. Its IUPAC name is [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine.

Molecular Properties

Compound Name[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine
PubChem CID102608146
Molecular FormulaC9H13NO3
Molecular Weight183.21 g/mol
Exact Mass183.09
IUPAC Name[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine
SMILESNCc1coc(COC2COC2)c1
InChIInChI=1S/C9H13NO3/c10-2-7-1-8(12-3-7)6-13-9-4-11-5-9/h1,3,9H,2,4-6,10H2
InChIKeyYSUSKYAPFSLWSZ-UHFFFAOYSA-N
XLogP0.65
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(oxetan-3-yloxymethyl)phenyl]methanamine
CID 102605746
[3-fluoro-5-(oxetan-3-yloxymethyl)phenyl]methanamine
CID 102605729
[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
CID 62457457
[3-fluoro-4-(oxetan-3-yloxymethyl)phenyl]methanamine
CID 102605734
[5-(3-methylbutoxymethyl)furan-3-yl]methanamine
CID 62444987
[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine
CID 62444313
1-[5-(cyclopentyloxymethyl)furan-3-yl]-N-methylmethanamine
CID 62444242
[5-(butoxymethyl)furan-3-yl]methanamine
CID 62451528
[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine
CID 62422880
[5-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)furan-3-yl]methanamine
CID 55075492
N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62444439
N-[2-[[4-(aminomethyl)furan-2-yl]methoxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 113325033

Frequently Asked Questions

What is the IUPAC name of [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine?
The IUPAC name of [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine (CID 102608146) is [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine.
What is the SMILES notation for [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine?
The canonical SMILES for [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine is NCc1coc(COC2COC2)c1.
What is the InChIKey of [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine?
The InChIKey is YSUSKYAPFSLWSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3/c10-2-7-1-8(12-3-7)6-13-9-4-11-5-9/h1,3,9H,2,4-6,10H2.
What are the key properties of [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine?
[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine has a molecular weight of 183.21 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine is sourced from PubChem (CID 102608146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).