[5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol

C10H18NO5P — CID 171192326

IUPAC[5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol
SMILESCCOP(=O)(OCC)[C@@H](N)c1ccc(CO)o1
InChIInChI=1S/C10H18NO5P/c1-3-14-17(13,15-4-2)10(11)9-6-5-8(7-12)16-9/h5-6,10,12H,3-4,7,11H2,1-2H3/t10-/m1/s1
InChIKeyRDWOVTXMUPHNNE-SNVBAGLBSA-N
MW263.23 g/mol
LogP2.00
Rot. Bonds7

About [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol

[5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol (PubChem CID 171192326) has the molecular formula C10H18NO5P and a molecular weight of 263.23 g/mol. Its IUPAC name is [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol
PubChem CID171192326
Molecular FormulaC10H18NO5P
Molecular Weight263.23 g/mol
Exact Mass263.09
IUPAC Name[5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol
SMILESCCOP(=O)(OCC)[C@@H](N)c1ccc(CO)o1
InChIInChI=1S/C10H18NO5P/c1-3-14-17(13,15-4-2)10(11)9-6-5-8(7-12)16-9/h5-6,10,12H,3-4,7,11H2,1-2H3/t10-/m1/s1
InChIKeyRDWOVTXMUPHNNE-SNVBAGLBSA-N
XLogP2.00
TPSA94.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.23
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

ethyl (3R)-3-amino-2-fluoro-3-[5-(hydroxymethyl)furan-2-yl]propanoate
CID 171243533
1-amino-1-[5-(hydroxymethyl)furan-2-yl]propan-2-one
CID 55292431
[5-[(1R)-1-amino-2,2-dimethylpropyl]furan-2-yl]methanol;hydrochloride
CID 171250266
2-[(S)-amino(diethoxyphosphoryl)methyl]phenol
CID 171191680
[5-[(1S)-1-aminobutyl]furan-2-yl]methanol;hydrochloride
CID 171231073
(S)-diethoxyphosphoryl-(4-iodophenyl)methanamine
CID 171191723
4-[(S)-amino(diethoxyphosphoryl)methyl]-3-fluorophenol
CID 171191642
(R)-(4-chlorophenyl)-diethoxyphosphorylmethanamine
CID 2313111
(S)-diethoxyphosphoryl-(5-ethylthiophen-2-yl)methanamine
CID 171191914
3-amino-3-[5-(hydroxymethyl)furan-2-yl]propanamide
CID 55255526
[4-[(R)-amino(diethoxyphosphoryl)methyl]phenyl] acetate
CID 171192289
[5-[(1S)-1,3-diaminopropyl]furan-2-yl]methanol
CID 171231063

Frequently Asked Questions

What is the IUPAC name of [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol?
The IUPAC name of [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol (CID 171192326) is [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol is CCOP(=O)(OCC)[C@@H](N)c1ccc(CO)o1.
What is the InChIKey of [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol?
The InChIKey is RDWOVTXMUPHNNE-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H18NO5P/c1-3-14-17(13,15-4-2)10(11)9-6-5-8(7-12)16-9/h5-6,10,12H,3-4,7,11H2,1-2H3/t10-/m1/s1.
What are the key properties of [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol?
[5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol has a molecular weight of 263.23 g/mol, XLogP of 2.00, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(R)-amino(diethoxyphosphoryl)methyl]furan-2-yl]methanol is sourced from PubChem (CID 171192326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).