3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea

C10H11FN2O2 — CID 12782787

IUPAC3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea
SMILESO=C(NC1CC1)N(O)c1ccccc1F
InChIInChI=1S/C10H11FN2O2/c11-8-3-1-2-4-9(8)13(15)10(14)12-7-5-6-7/h1-4,7,15H,5-6H2,(H,12,14)
InChIKeyMJOHBGWMKMVSSX-UHFFFAOYSA-N
MW210.21 g/mol
LogP1.89
Rot. Bonds2

About 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea

3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea (PubChem CID 12782787) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea.

Molecular Properties

Compound Name3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea
PubChem CID12782787
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea
SMILESO=C(NC1CC1)N(O)c1ccccc1F
InChIInChI=1S/C10H11FN2O2/c11-8-3-1-2-4-9(8)13(15)10(14)12-7-5-6-7/h1-4,7,15H,5-6H2,(H,12,14)
InChIKeyMJOHBGWMKMVSSX-UHFFFAOYSA-N
XLogP1.89
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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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Related Compounds

3-cyclohexyl-1-(2-fluorophenyl)-1-methylurea;hydrochloride
CID 174490608
3-cyclopropyl-1-(2-fluorophenyl)-1-methylthiourea
CID 116508220
3-[[ethyl-(2-fluorophenyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 66030847
methyl 2-[cyclopropylcarbamoyl(methyl)amino]benzoate
CID 62700811
1-[(2-fluorophenyl)methyl]-3-(4-hydroxycyclohexyl)-1-methylurea
CID 47238706
N-cyclopentyl-2-(2-fluoro-N-thiophen-2-ylsulfonylanilino)acetamide
CID 30256064
N-cyclopropyl-2,3-difluorobenzamide
CID 62648987
(2S)-2-(2-fluoro-N-methylsulfonylanilino)-N-(1-methylpiperidin-4-yl)propanamide
CID 99131997
N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 53016800
N-cyclopropyl-2-[[3-(2-fluorophenyl)-2-oxopropyl]-methylamino]acetamide
CID 62035342
2-[[(2-fluorophenyl)-methylcarbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64816362
1-cyclopentyl-3-[3-(2-fluoro-N-methylanilino)propyl]urea
CID 60544274

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea?
The IUPAC name of 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea (CID 12782787) is 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea.
What is the SMILES notation for 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea?
The canonical SMILES for 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea is O=C(NC1CC1)N(O)c1ccccc1F.
What is the InChIKey of 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea?
The InChIKey is MJOHBGWMKMVSSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c11-8-3-1-2-4-9(8)13(15)10(14)12-7-5-6-7/h1-4,7,15H,5-6H2,(H,12,14).
What are the key properties of 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea?
3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea has a molecular weight of 210.21 g/mol, XLogP of 1.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2-fluorophenyl)-1-hydroxyurea is sourced from PubChem (CID 12782787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).