N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide

C11H26N4O2S — CID 114141798

IUPACN',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide
SMILESCCCNCC1CCN(S(=O)(=O)NN(C)C)CC1
InChIInChI=1S/C11H26N4O2S/c1-4-7-12-10-11-5-8-15(9-6-11)18(16,17)13-14(2)3/h11-13H,4-10H2,1-3H3
InChIKeyFJWLRGMTRABWSQ-UHFFFAOYSA-N
MW278.42 g/mol
LogP0.01
Rot. Bonds7

About N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide

N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide (PubChem CID 114141798) has the molecular formula C11H26N4O2S and a molecular weight of 278.42 g/mol. Its IUPAC name is N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide
PubChem CID114141798
Molecular FormulaC11H26N4O2S
Molecular Weight278.42 g/mol
Exact Mass278.18
IUPAC NameN',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide
SMILESCCCNCC1CCN(S(=O)(=O)NN(C)C)CC1
InChIInChI=1S/C11H26N4O2S/c1-4-7-12-10-11-5-8-15(9-6-11)18(16,17)13-14(2)3/h11-13H,4-10H2,1-3H3
InChIKeyFJWLRGMTRABWSQ-UHFFFAOYSA-N
XLogP0.01
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2,2-difluoroethyl)-4-(propylaminomethyl)piperidine-1-sulfonamide
CID 115409103
N-(1,2-oxazol-5-ylmethyl)-4-(propylaminomethyl)piperidine-1-sulfonamide
CID 106423900
N-(2-ethoxypropyl)-4-(propylaminomethyl)piperidine-1-sulfonamide
CID 106078679
N-methyl-N-(2-methylsulfanylethyl)-4-(propylaminomethyl)piperidine-1-sulfonamide
CID 115988307
4-(propylaminomethyl)-N-(1H-pyrazol-4-ylmethyl)piperidine-1-sulfonamide
CID 106015942
4-[(2-methylpropylamino)methyl]-N-propylpiperidine-1-sulfonamide
CID 114813088
N-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methyl]propan-1-amine
CID 63879144
N-[[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]methyl]propan-1-amine
CID 63880352
N-[[1-(1,2-dimethylimidazol-4-yl)sulfonylpiperidin-4-yl]methyl]propan-1-amine
CID 63877764
N,N-dimethyl-2-[4-(propylaminomethyl)piperidin-1-yl]acetamide
CID 63849787
N-[2-(dimethylamino)propyl]-4-(ethylaminomethyl)piperidine-1-sulfonamide
CID 106017143
N-[[1-(2-methylpropyl)piperidin-4-yl]methyl]propan-1-amine
CID 62593266

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide?
The IUPAC name of N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide (CID 114141798) is N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide.
What is the SMILES notation for N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide?
The canonical SMILES for N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide is CCCNCC1CCN(S(=O)(=O)NN(C)C)CC1.
What is the InChIKey of N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide?
The InChIKey is FJWLRGMTRABWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N4O2S/c1-4-7-12-10-11-5-8-15(9-6-11)18(16,17)13-14(2)3/h11-13H,4-10H2,1-3H3.
What are the key properties of N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide?
N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide has a molecular weight of 278.42 g/mol, XLogP of 0.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-4-(propylaminomethyl)piperidine-1-sulfonohydrazide is sourced from PubChem (CID 114141798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).