1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea

C15H16N2O3 — CID 18646415

IUPAC1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea
SMILESNC(=O)N(O)C[C@@H]1C[C@H]1c1ccc(-c2ccccc2)o1
InChIInChI=1S/C15H16N2O3/c16-15(18)17(19)9-11-8-12(11)14-7-6-13(20-14)10-4-2-1-3-5-10/h1-7,11-12,19H,8-9H2,(H2,16,18)/t11-,12+/m0/s1
InChIKeyNGBJYSDDEHMGDM-NWDGAFQWSA-N
MW272.30 g/mol
LogP2.82
Rot. Bonds4

About 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea

1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea (PubChem CID 18646415) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea.

Molecular Properties

Compound Name1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea
PubChem CID18646415
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea
SMILESNC(=O)N(O)C[C@@H]1C[C@H]1c1ccc(-c2ccccc2)o1
InChIInChI=1S/C15H16N2O3/c16-15(18)17(19)9-11-8-12(11)14-7-6-13(20-14)10-4-2-1-3-5-10/h1-7,11-12,19H,8-9H2,(H2,16,18)/t11-,12+/m0/s1
InChIKeyNGBJYSDDEHMGDM-NWDGAFQWSA-N
XLogP2.82
TPSA79.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.82
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-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea?
The IUPAC name of 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea (CID 18646415) is 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea.
What is the SMILES notation for 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea?
The canonical SMILES for 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea is NC(=O)N(O)C[C@@H]1C[C@H]1c1ccc(-c2ccccc2)o1.
What is the InChIKey of 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea?
The InChIKey is NGBJYSDDEHMGDM-NWDGAFQWSA-N. The full InChI is InChI=1S/C15H16N2O3/c16-15(18)17(19)9-11-8-12(11)14-7-6-13(20-14)10-4-2-1-3-5-10/h1-7,11-12,19H,8-9H2,(H2,16,18)/t11-,12+/m0/s1.
What are the key properties of 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea?
1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea has a molecular weight of 272.30 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-[[(1R,2R)-2-(5-phenylfuran-2-yl)cyclopropyl]methyl]urea is sourced from PubChem (CID 18646415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).