N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide

C16H18FN3O3S — CID 91626438

IUPACN-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide
SMILESO=S(=O)(NC1CCC(Oc2ncc(F)cn2)CC1)c1ccccc1
InChIInChI=1S/C16H18FN3O3S/c17-12-10-18-16(19-11-12)23-14-8-6-13(7-9-14)20-24(21,22)15-4-2-1-3-5-15/h1-5,10-11,13-14,20H,6-9H2
InChIKeyKEPYRCSAQWTQMW-UHFFFAOYSA-N
MW351.40 g/mol
LogP2.28
Rot. Bonds5

About N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide

N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide (PubChem CID 91626438) has the molecular formula C16H18FN3O3S and a molecular weight of 351.40 g/mol. Its IUPAC name is N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide
PubChem CID91626438
Molecular FormulaC16H18FN3O3S
Molecular Weight351.40 g/mol
Exact Mass351.11
IUPAC NameN-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide
SMILESO=S(=O)(NC1CCC(Oc2ncc(F)cn2)CC1)c1ccccc1
InChIInChI=1S/C16H18FN3O3S/c17-12-10-18-16(19-11-12)23-14-8-6-13(7-9-14)20-24(21,22)15-4-2-1-3-5-15/h1-5,10-11,13-14,20H,6-9H2
InChIKeyKEPYRCSAQWTQMW-UHFFFAOYSA-N
XLogP2.28
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide 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-(4-pyrimidin-2-yloxycyclohexyl)benzenesulfonamide
CID 90633513
N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 90634541
2,5-difluoro-N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide
CID 90634538
3-chloro-N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]-2-methylbenzenesulfonamide
CID 90634528
N-[4-(5-chloropyrimidin-2-yl)oxycyclohexyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 90634047
4-cyano-N-(4-pyrimidin-2-yloxycyclohexyl)benzenesulfonamide
CID 91626350
1-(2,5-difluorophenyl)-N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]methanesulfonamide
CID 90634554
(E)-N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]-2-(4-methylphenyl)ethenesulfonamide
CID 90634548
N-[4-(5-chloropyrimidin-2-yl)oxycyclohexyl]-4-propan-2-yloxybenzenesulfonamide
CID 90634090
N-[4-(5-chloropyrimidin-2-yl)oxycyclohexyl]-3,4-dimethylbenzenesulfonamide
CID 90634026
N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]-3-phenylpropanamide
CID 91626381
1-benzhydryl-3-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]urea
CID 90634472

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide?
The IUPAC name of N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide (CID 91626438) is N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide.
What is the SMILES notation for N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide?
The canonical SMILES for N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide is O=S(=O)(NC1CCC(Oc2ncc(F)cn2)CC1)c1ccccc1.
What is the InChIKey of N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide?
The InChIKey is KEPYRCSAQWTQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O3S/c17-12-10-18-16(19-11-12)23-14-8-6-13(7-9-14)20-24(21,22)15-4-2-1-3-5-15/h1-5,10-11,13-14,20H,6-9H2.
What are the key properties of N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide?
N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide has a molecular weight of 351.40 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide is sourced from PubChem (CID 91626438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).