N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide

C14H23N3O2S2 — CID 171324302

IUPACN-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide
SMILESCc1csc(N2CCC(CN(C)S(=O)(=O)C3CC3)CC2)n1
InChIInChI=1S/C14H23N3O2S2/c1-11-10-20-14(15-11)17-7-5-12(6-8-17)9-16(2)21(18,19)13-3-4-13/h10,12-13H,3-9H2,1-2H3
InChIKeyQZJSNGAGBCVSJQ-UHFFFAOYSA-N
MW329.49 g/mol
LogP2.09
Rot. Bonds5

About N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide

N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide (PubChem CID 171324302) has the molecular formula C14H23N3O2S2 and a molecular weight of 329.49 g/mol. Its IUPAC name is N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide
PubChem CID171324302
Molecular FormulaC14H23N3O2S2
Molecular Weight329.49 g/mol
Exact Mass329.12
IUPAC NameN-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide
SMILESCc1csc(N2CCC(CN(C)S(=O)(=O)C3CC3)CC2)n1
InChIInChI=1S/C14H23N3O2S2/c1-11-10-20-14(15-11)17-7-5-12(6-8-17)9-16(2)21(18,19)13-3-4-13/h10,12-13H,3-9H2,1-2H3
InChIKeyQZJSNGAGBCVSJQ-UHFFFAOYSA-N
XLogP2.09
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide?
The IUPAC name of N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide (CID 171324302) is N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide.
What is the SMILES notation for N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide?
The canonical SMILES for N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide is Cc1csc(N2CCC(CN(C)S(=O)(=O)C3CC3)CC2)n1.
What is the InChIKey of N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide?
The InChIKey is QZJSNGAGBCVSJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S2/c1-11-10-20-14(15-11)17-7-5-12(6-8-17)9-16(2)21(18,19)13-3-4-13/h10,12-13H,3-9H2,1-2H3.
What are the key properties of N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide?
N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide has a molecular weight of 329.49 g/mol, XLogP of 2.09, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[1-(4-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl]cyclopropanesulfonamide is sourced from PubChem (CID 171324302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).