1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea

C17H21FN4O2 — CID 110321086

IUPAC1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea
SMILESO=C(NCCc1nnc(-c2ccc(F)cc2)o1)NC1CCCCC1
InChIInChI=1S/C17H21FN4O2/c18-13-8-6-12(7-9-13)16-22-21-15(24-16)10-11-19-17(23)20-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H2,19,20,23)
InChIKeyIAZPALGLMUTDMO-UHFFFAOYSA-N
MW332.38 g/mol
LogP3.05
Rot. Bonds5

About 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea

1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea (PubChem CID 110321086) has the molecular formula C17H21FN4O2 and a molecular weight of 332.38 g/mol. Its IUPAC name is 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea.

Molecular Properties

Compound Name1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea
PubChem CID110321086
Molecular FormulaC17H21FN4O2
Molecular Weight332.38 g/mol
Exact Mass332.16
IUPAC Name1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea
SMILESO=C(NCCc1nnc(-c2ccc(F)cc2)o1)NC1CCCCC1
InChIInChI=1S/C17H21FN4O2/c18-13-8-6-12(7-9-13)16-22-21-15(24-16)10-11-19-17(23)20-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H2,19,20,23)
InChIKeyIAZPALGLMUTDMO-UHFFFAOYSA-N
XLogP3.05
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.38
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]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

N-cycloheptyl-3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 9082261
N-(cyclohexylcarbamoyl)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CID 4804307
N-cyclopentyl-3-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 42346090
N-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]thiophene-2-carboxamide
CID 110321054
2-chloro-6-fluoro-N-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]benzamide
CID 110321097
3-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]-1-piperidin-1-ylpropan-1-one
CID 110333957
N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopropanamine
CID 55021274
N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]cyclopropanecarboxamide
CID 110320787
1-cyclohexyl-3-[2-(5-fluoro-2-methoxyphenyl)ethyl]urea
CID 110775679
1-cyclopentyl-3-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]propanoylamino]thiourea
CID 9090178
N-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]propan-1-amine
CID 55044396
4-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]butanoic acid
CID 39352729

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea?
The IUPAC name of 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea (CID 110321086) is 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea.
What is the SMILES notation for 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea?
The canonical SMILES for 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea is O=C(NCCc1nnc(-c2ccc(F)cc2)o1)NC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea?
The InChIKey is IAZPALGLMUTDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4O2/c18-13-8-6-12(7-9-13)16-22-21-15(24-16)10-11-19-17(23)20-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H2,19,20,23).
What are the key properties of 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea?
1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea has a molecular weight of 332.38 g/mol, XLogP of 3.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[2-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]urea is sourced from PubChem (CID 110321086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).