N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide

C11H16N4O2S — CID 122298341

IUPACN-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1cnc(N2CCCC2)nc1)C1CC1
InChIInChI=1S/C11H16N4O2S/c16-18(17,10-3-4-10)14-9-7-12-11(13-8-9)15-5-1-2-6-15/h7-8,10,14H,1-6H2
InChIKeyAVLVPKSDOMCVMU-UHFFFAOYSA-N
MW268.34 g/mol
LogP0.98
Rot. Bonds4

About N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide

N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide (PubChem CID 122298341) has the molecular formula C11H16N4O2S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide
PubChem CID122298341
Molecular FormulaC11H16N4O2S
Molecular Weight268.34 g/mol
Exact Mass268.10
IUPAC NameN-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1cnc(N2CCCC2)nc1)C1CC1
InChIInChI=1S/C11H16N4O2S/c16-18(17,10-3-4-10)14-9-7-12-11(13-8-9)15-5-1-2-6-15/h7-8,10,14H,1-6H2
InChIKeyAVLVPKSDOMCVMU-UHFFFAOYSA-N
XLogP0.98
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide?
The IUPAC name of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide (CID 122298341) is N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide is O=S(=O)(Nc1cnc(N2CCCC2)nc1)C1CC1.
What is the InChIKey of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide?
The InChIKey is AVLVPKSDOMCVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2S/c16-18(17,10-3-4-10)14-9-7-12-11(13-8-9)15-5-1-2-6-15/h7-8,10,14H,1-6H2.
What are the key properties of N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide?
N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide has a molecular weight of 268.34 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-ylpyrimidin-5-yl)cyclopropanesulfonamide is sourced from PubChem (CID 122298341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).