[5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol

C10H17NO3 — CID 64577829

IUPAC[5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol
SMILESCOCCCNCc1ccc(CO)o1
InChIInChI=1S/C10H17NO3/c1-13-6-2-5-11-7-9-3-4-10(8-12)14-9/h3-4,11-12H,2,5-8H2,1H3
InChIKeyFPFRULXXEWBVIF-UHFFFAOYSA-N
MW199.25 g/mol
LogP0.90
Rot. Bonds7

About [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol

[5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol (PubChem CID 64577829) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol
PubChem CID64577829
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name[5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol
SMILESCOCCCNCc1ccc(CO)o1
InChIInChI=1S/C10H17NO3/c1-13-6-2-5-11-7-9-3-4-10(8-12)14-9/h3-4,11-12H,2,5-8H2,1H3
InChIKeyFPFRULXXEWBVIF-UHFFFAOYSA-N
XLogP0.90
TPSA54.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[5-[[2-(2-methoxyethoxy)ethylamino]methyl]furan-2-yl]methanol
CID 64593159
3-methoxy-N-[[5-(methoxymethyl)furan-2-yl]methyl]propan-1-amine
CID 115710392
N-[(5-chlorofuran-2-yl)methyl]-3-methoxypropan-1-amine
CID 60662772
3-[[5-(methoxymethyl)furan-2-yl]methylamino]propan-1-ol
CID 115710395
[5-[(2-butoxyethylamino)methyl]furan-2-yl]methanol
CID 64591603
5-[[5-(hydroxymethyl)furan-2-yl]methylamino]pentan-2-ol
CID 107267638
2-[[5-(methoxymethyl)furan-2-yl]methylamino]ethanol
CID 12655820
methyl 5-[[4-(2-methoxyethoxy)butylamino]methyl]furan-2-carboxylate
CID 115905245
N-[[5-(2-fluorophenyl)furan-2-yl]methyl]-3-methoxypropan-1-amine
CID 17206989
3-[(5-ethylfuran-2-yl)methylamino]propan-1-ol
CID 62346673
[5-[[[(2S)-1-methoxypropan-2-yl]amino]methyl]furan-2-yl]methanol
CID 96569409
[5-[(2-methylsulfinylethylamino)methyl]furan-2-yl]methanol
CID 115654111

Frequently Asked Questions

What is the IUPAC name of [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol?
The IUPAC name of [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol (CID 64577829) is [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol is COCCCNCc1ccc(CO)o1.
What is the InChIKey of [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol?
The InChIKey is FPFRULXXEWBVIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-13-6-2-5-11-7-9-3-4-10(8-12)14-9/h3-4,11-12H,2,5-8H2,1H3.
What are the key properties of [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol?
[5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol has a molecular weight of 199.25 g/mol, XLogP of 0.90, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-methoxypropylamino)methyl]furan-2-yl]methanol is sourced from PubChem (CID 64577829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).