N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide

C15H29N3O2S — CID 106608661

IUPACN-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C15H29N3O2S/c1-13-5-2-3-10-18(13)21(19,20)17(11-14-7-8-14)12-15-6-4-9-16-15/h13-16H,2-12H2,1H3
InChIKeyODYKMJQZZGOSIQ-UHFFFAOYSA-N
MW315.48 g/mol
LogP1.57
Rot. Bonds6

About N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide

N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide (PubChem CID 106608661) has the molecular formula C15H29N3O2S and a molecular weight of 315.48 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
PubChem CID106608661
Molecular FormulaC15H29N3O2S
Molecular Weight315.48 g/mol
Exact Mass315.20
IUPAC NameN-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C15H29N3O2S/c1-13-5-2-3-10-18(13)21(19,20)17(11-14-7-8-14)12-15-6-4-9-16-15/h13-16H,2-12H2,1H3
InChIKeyODYKMJQZZGOSIQ-UHFFFAOYSA-N
XLogP1.57
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.48
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608896
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
CID 106608788
N-ethyl-4-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608209
N-ethyl-4-methyl-N-(piperidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106630251
2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine
CID 106608854
N-methyl-N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide
CID 106607328
N-methyl-N-(piperidin-2-ylmethyl)azepane-1-sulfonamide
CID 106630525
3,5-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608418
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106608787
N-(2-hydroxyethyl)-3,5-dimethyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106610223
ethyl 2-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)sulfamoyl]acetate
CID 106608776
N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106608711

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide (CID 106608661) is N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)N(CC1CC1)CC1CCCN1.
What is the InChIKey of N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide?
The InChIKey is ODYKMJQZZGOSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2S/c1-13-5-2-3-10-18(13)21(19,20)17(11-14-7-8-14)12-15-6-4-9-16-15/h13-16H,2-12H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide?
N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide has a molecular weight of 315.48 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide is sourced from PubChem (CID 106608661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).