N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide

C13H19N3O3S — CID 91626345

IUPACN-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCC(Oc2ncccn2)CC1)C1CC1
InChIInChI=1S/C13H19N3O3S/c17-20(18,12-6-7-12)16-10-2-4-11(5-3-10)19-13-14-8-1-9-15-13/h1,8-12,16H,2-7H2
InChIKeyHPTPZXFRDOWRCH-UHFFFAOYSA-N
MW297.38 g/mol
LogP1.25
Rot. Bonds5

About N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide

N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide (PubChem CID 91626345) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide
PubChem CID91626345
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC NameN-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCC(Oc2ncccn2)CC1)C1CC1
InChIInChI=1S/C13H19N3O3S/c17-20(18,12-6-7-12)16-10-2-4-11(5-3-10)19-13-14-8-1-9-15-13/h1,8-12,16H,2-7H2
InChIKeyHPTPZXFRDOWRCH-UHFFFAOYSA-N
XLogP1.25
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-pyrimidin-2-yloxycyclohexyl)propane-1-sulfonamide
CID 90633512
N-(4-pyrimidin-2-yloxycyclohexyl)benzenesulfonamide
CID 90633513
N-methyl-4-pyrimidin-2-yloxycyclohexan-1-amine
CID 20607230
N-(4-pyrimidin-2-yloxycyclohexyl)thiophene-2-sulfonamide
CID 91626336
3,5-dimethyl-N-(4-pyrimidin-2-yloxycyclohexyl)-1,2-oxazole-4-sulfonamide
CID 91626338
4-cyano-N-(4-pyrimidin-2-yloxycyclohexyl)benzenesulfonamide
CID 91626350
1,3,5-trimethyl-N-(4-pyrimidin-2-yloxycyclohexyl)pyrazole-4-sulfonamide
CID 91626349
N-(4-pyrimidin-2-yloxycyclohexyl)cyclopentanecarboxamide
CID 90633226
2-[methyl(methylsulfonyl)amino]-N-(4-pyrimidin-2-yloxycyclohexyl)acetamide
CID 91626284
N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]benzenesulfonamide
CID 91626438
1-ethyl-3-(4-pyrimidin-2-yloxycyclohexyl)urea
CID 90633499
2-piperidin-4-yloxypyrimidine
CID 3836732

Frequently Asked Questions

What is the IUPAC name of N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide?
The IUPAC name of N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide (CID 91626345) is N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide?
The canonical SMILES for N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide is O=S(=O)(NC1CCC(Oc2ncccn2)CC1)C1CC1.
What is the InChIKey of N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide?
The InChIKey is HPTPZXFRDOWRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c17-20(18,12-6-7-12)16-10-2-4-11(5-3-10)19-13-14-8-1-9-15-13/h1,8-12,16H,2-7H2.
What are the key properties of N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide?
N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide has a molecular weight of 297.38 g/mol, XLogP of 1.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrimidin-2-yloxycyclohexyl)cyclopropanesulfonamide is sourced from PubChem (CID 91626345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).