1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea

C15H18N2O4 — CID 10755909

IUPAC1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea
SMILESCC(c1ccc(COCc2ccccc2)o1)N(O)C(N)=O
InChIInChI=1S/C15H18N2O4/c1-11(17(19)15(16)18)14-8-7-13(21-14)10-20-9-12-5-3-2-4-6-12/h2-8,11,19H,9-10H2,1H3,(H2,16,18)
InChIKeyLVMYDBXPMONGHK-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.83
Rot. Bonds6

About 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea

1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea (PubChem CID 10755909) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea.

Molecular Properties

Compound Name1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea
PubChem CID10755909
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea
SMILESCC(c1ccc(COCc2ccccc2)o1)N(O)C(N)=O
InChIInChI=1S/C15H18N2O4/c1-11(17(19)15(16)18)14-8-7-13(21-14)10-20-9-12-5-3-2-4-6-12/h2-8,11,19H,9-10H2,1H3,(H2,16,18)
InChIKeyLVMYDBXPMONGHK-UHFFFAOYSA-N
XLogP2.83
TPSA88.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea?
The IUPAC name of 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea (CID 10755909) is 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea.
What is the SMILES notation for 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea?
The canonical SMILES for 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea is CC(c1ccc(COCc2ccccc2)o1)N(O)C(N)=O.
What is the InChIKey of 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea?
The InChIKey is LVMYDBXPMONGHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-11(17(19)15(16)18)14-8-7-13(21-14)10-20-9-12-5-3-2-4-6-12/h2-8,11,19H,9-10H2,1H3,(H2,16,18).
What are the key properties of 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea?
1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea has a molecular weight of 290.32 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-[1-[5-(phenylmethoxymethyl)furan-2-yl]ethyl]urea is sourced from PubChem (CID 10755909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).