N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide

C13H26N2O3S — CID 146090184

IUPACN-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide
SMILESCC1CCCN(CC(C)NS(=O)(=O)C2CCOC2)C1
InChIInChI=1S/C13H26N2O3S/c1-11-4-3-6-15(8-11)9-12(2)14-19(16,17)13-5-7-18-10-13/h11-14H,3-10H2,1-2H3
InChIKeyUQRRFUCLRZVNMY-UHFFFAOYSA-N
MW290.43 g/mol
LogP0.82
Rot. Bonds5

About N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide

N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide (PubChem CID 146090184) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide.

Molecular Properties

Compound NameN-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide
PubChem CID146090184
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC NameN-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide
SMILESCC1CCCN(CC(C)NS(=O)(=O)C2CCOC2)C1
InChIInChI=1S/C13H26N2O3S/c1-11-4-3-6-15(8-11)9-12(2)14-19(16,17)13-5-7-18-10-13/h11-14H,3-10H2,1-2H3
InChIKeyUQRRFUCLRZVNMY-UHFFFAOYSA-N
XLogP0.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-N-[(2R)-1-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propan-2-yl]oxolane-3-sulfonamide
CID 97225704
N-[1-(3-methylpiperidin-1-yl)propan-2-yl]methanesulfonamide
CID 91662016
(3R)-N-propan-2-yloxolane-3-sulfonamide
CID 97175132
N-[(2R)-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]-2-[(2S)-oxolan-2-yl]ethanesulfonamide
CID 99827324
N-[(2R)-1-piperidin-1-ylpropan-2-yl]cyclopropanesulfonamide
CID 99827272
3-methyl-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]piperidine-1-carboxamide
CID 60577941
N-[(2R)-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]-1H-imidazole-5-sulfonamide
CID 99793097
N-propan-2-yloxane-3-sulfonamide
CID 130684869
3-amino-N-[(2R)-1-[(3S)-3-methylpiperidin-1-yl]propan-2-yl]benzenesulfonamide
CID 129408262
2-amino-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]acetamide
CID 119863261
3-methyl-1-(oxolan-3-ylmethyl)piperidine
CID 77147821
N-[1-(3-methylpiperidin-1-yl)propan-2-yl]morpholine-2-carboxamide
CID 119863275

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide?
The IUPAC name of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide (CID 146090184) is N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide.
What is the SMILES notation for N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide?
The canonical SMILES for N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide is CC1CCCN(CC(C)NS(=O)(=O)C2CCOC2)C1.
What is the InChIKey of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide?
The InChIKey is UQRRFUCLRZVNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3S/c1-11-4-3-6-15(8-11)9-12(2)14-19(16,17)13-5-7-18-10-13/h11-14H,3-10H2,1-2H3.
What are the key properties of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide?
N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide has a molecular weight of 290.43 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylpiperidin-1-yl)propan-2-yl]oxolane-3-sulfonamide is sourced from PubChem (CID 146090184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).