N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide

C11H16N4O2S — CID 167035052

IUPACN-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1nccc(C2CCCN2)n1)C1CC1
InChIInChI=1S/C11H16N4O2S/c16-18(17,8-3-4-8)15-11-13-7-5-10(14-11)9-2-1-6-12-9/h5,7-9,12H,1-4,6H2,(H,13,14,15)
InChIKeyJUGMYDIRTAGHHY-UHFFFAOYSA-N
MW268.34 g/mol
LogP0.81
Rot. Bonds4

About N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide

N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide (PubChem CID 167035052) has the molecular formula C11H16N4O2S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide
PubChem CID167035052
Molecular FormulaC11H16N4O2S
Molecular Weight268.34 g/mol
Exact Mass268.10
IUPAC NameN-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1nccc(C2CCCN2)n1)C1CC1
InChIInChI=1S/C11H16N4O2S/c16-18(17,8-3-4-8)15-11-13-7-5-10(14-11)9-2-1-6-12-9/h5,7-9,12H,1-4,6H2,(H,13,14,15)
InChIKeyJUGMYDIRTAGHHY-UHFFFAOYSA-N
XLogP0.81
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-pyrimidin-2-yl-4-[(2R)-pyrrolidin-2-yl]pyrimidin-2-amine
CID 95836667
N-methyl-4-[(2S)-piperidin-2-yl]pyrimidin-2-amine
CID 95827769
5-methoxy-2-methyl-N-(4-piperidin-2-ylpyrimidin-2-yl)benzenesulfonamide
CID 166305722
4-pyrrolidin-2-ylpyrimidin-2-amine
CID 53408029
6-N-methyl-4-N-[4-[(2R)-pyrrolidin-2-yl]pyrimidin-2-yl]pyrimidine-4,6-diamine
CID 95836671
4-piperidin-2-yl-N-pyrazin-2-ylpyrimidin-2-amine
CID 110266729
4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine
CID 75485556
5-methyl-N-(4-piperidin-2-ylpyrimidin-2-yl)-1,3-thiazol-2-amine;dihydrochloride
CID 171700358
2-[(2R)-pyrrolidin-2-yl]pyridine
CID 7141590
2-fluoro-6-[(2R)-pyrrolidin-2-yl]pyridine
CID 131118553
6-[(2S)-pyrrolidin-2-yl]pyridin-2-amine
CID 55274090
6-[(2R)-pyrrolidin-2-yl]pyridine-2-carbaldehyde
CID 87404647

Frequently Asked Questions

What is the IUPAC name of N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide?
The IUPAC name of N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide (CID 167035052) is N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide is O=S(=O)(Nc1nccc(C2CCCN2)n1)C1CC1.
What is the InChIKey of N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide?
The InChIKey is JUGMYDIRTAGHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2S/c16-18(17,8-3-4-8)15-11-13-7-5-10(14-11)9-2-1-6-12-9/h5,7-9,12H,1-4,6H2,(H,13,14,15).
What are the key properties of N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide?
N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide has a molecular weight of 268.34 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide is sourced from PubChem (CID 167035052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).