N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide

C13H26N2O2S — CID 78848929

IUPACN-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide
SMILESCCCN(CC1CC1)S(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C13H26N2O2S/c1-3-8-14(11-13-6-7-13)18(16,17)15-9-4-5-12(2)10-15/h12-13H,3-11H2,1-2H3
InChIKeyBMGAZQZMJKMNJT-UHFFFAOYSA-N
MW274.43 g/mol
LogP2.09
Rot. Bonds6

About N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide

N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide (PubChem CID 78848929) has the molecular formula C13H26N2O2S and a molecular weight of 274.43 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide
PubChem CID78848929
Molecular FormulaC13H26N2O2S
Molecular Weight274.43 g/mol
Exact Mass274.17
IUPAC NameN-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide
SMILESCCCN(CC1CC1)S(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C13H26N2O2S/c1-3-8-14(11-13-6-7-13)18(16,17)15-9-4-5-12(2)10-15/h12-13H,3-11H2,1-2H3
InChIKeyBMGAZQZMJKMNJT-UHFFFAOYSA-N
XLogP2.09
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[(3-methylpiperidin-1-yl)sulfonyl-propylamino]acetate
CID 54942106
N-butyl-N-(2-hydroxyethyl)-3-methylpiperidine-1-sulfonamide
CID 61448219
N-(3-aminopropyl)-N-ethyl-3-methylpiperidine-1-sulfonamide
CID 43136910
3-hydroxy-N,N-dipropylpiperidine-1-sulfonamide
CID 43502985
N-(azetidin-3-yl)-3-methyl-N-propylpiperidine-1-sulfonamide
CID 66214864
1-(dipropylsulfamoyl)piperidine-3-carboxylic acid
CID 43169481
N,3-dimethyl-N-(piperidin-4-ylmethyl)piperidine-1-sulfonamide
CID 79716652
N-[1-(aminomethyl)cyclopentyl]-3-methyl-N-propylpiperidine-1-sulfonamide
CID 62009026
3,5-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608418
N-(2-cyanopropyl)-N-ethyl-3-methylpiperidine-1-sulfonamide
CID 54983626
N-[(3-bromocyclobutyl)methyl]-N,3-dimethylpiperidine-1-sulfonamide
CID 80674883
3-[2-methoxyethyl-(3-methylpiperidin-1-yl)sulfonylamino]propanethioamide
CID 63285443

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide (CID 78848929) is N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide is CCCN(CC1CC1)S(=O)(=O)N1CCCC(C)C1.
What is the InChIKey of N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide?
The InChIKey is BMGAZQZMJKMNJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2S/c1-3-8-14(11-13-6-7-13)18(16,17)15-9-4-5-12(2)10-15/h12-13H,3-11H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide?
N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide has a molecular weight of 274.43 g/mol, XLogP of 2.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-methyl-N-propylpiperidine-1-sulfonamide is sourced from PubChem (CID 78848929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).