1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea

C14H14N2O3 — CID 54030031

IUPAC1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea
SMILESNC(=O)N(O)CC=Cc1ccc(-c2ccccc2)o1
InChIInChI=1S/C14H14N2O3/c15-14(17)16(18)10-4-7-12-8-9-13(19-12)11-5-2-1-3-6-11/h1-9,18H,10H2,(H2,15,17)
InChIKeyLEXWFVJWXZBMPB-UHFFFAOYSA-N
MW258.28 g/mol
LogP2.73
Rot. Bonds4

About 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea

1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea (PubChem CID 54030031) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea.

Molecular Properties

Compound Name1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea
PubChem CID54030031
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea
SMILESNC(=O)N(O)CC=Cc1ccc(-c2ccccc2)o1
InChIInChI=1S/C14H14N2O3/c15-14(17)16(18)10-4-7-12-8-9-13(19-12)11-5-2-1-3-6-11/h1-9,18H,10H2,(H2,15,17)
InChIKeyLEXWFVJWXZBMPB-UHFFFAOYSA-N
XLogP2.73
TPSA79.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenyl-5-[(Z)-2-(5-phenylfuran-2-yl)ethenyl]furan
CID 11381399
(E)-3-(5-phenylfuran-2-yl)prop-2-enoic acid
CID 836337
(Z)-2-cyano-3-(5-phenylfuran-2-yl)prop-2-enamide
CID 726345
1-(furan-2-yl)-3-(5-phenylfuran-2-yl)prop-2-en-1-one
CID 2753271
1-[(5-phenylfuran-2-yl)methylideneamino]butan-2-one
CID 157308513
(Z)-2-cyano-3-(5-phenylfuran-2-yl)prop-2-enoic acid
CID 787027
3-[5-[3-[hydroxy(oxido)amino]phenyl]furan-2-yl]-1-phenylprop-2-en-1-one
CID 163171437
1-hydroxy-1-(2-phenylethyl)urea
CID 10241398
4-[5-(2-carboxyethenyl)furan-2-yl]benzoic acid
CID 171146640
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-3-(5-phenylfuran-2-yl)propanamide
CID 42377200
1-ethylsulfanyl-3-[(E)-(5-phenylfuran-2-yl)methylideneamino]urea
CID 22299686
furan;5-phenylfuran-2-carbaldehyde
CID 175007564

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea?
The IUPAC name of 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea (CID 54030031) is 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea.
What is the SMILES notation for 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea?
The canonical SMILES for 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea is NC(=O)N(O)CC=Cc1ccc(-c2ccccc2)o1.
What is the InChIKey of 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea?
The InChIKey is LEXWFVJWXZBMPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c15-14(17)16(18)10-4-7-12-8-9-13(19-12)11-5-2-1-3-6-11/h1-9,18H,10H2,(H2,15,17).
What are the key properties of 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea?
1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea has a molecular weight of 258.28 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-[3-(5-phenylfuran-2-yl)prop-2-enyl]urea is sourced from PubChem (CID 54030031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).