N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride

C12H26ClN3O2S — CID 120714929

IUPACN-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride
SMILESCNC1CCCN(S(=O)(=O)N2CCCCC2C)C1.Cl
InChIInChI=1S/C12H25N3O2S.ClH/c1-11-6-3-4-9-15(11)18(16,17)14-8-5-7-12(10-14)13-2;/h11-13H,3-10H2,1-2H3;1H
InChIKeyIZUKDHRTRUHXFW-UHFFFAOYSA-N
MW311.88 g/mol
LogP1.21
Rot. Bonds3

About N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride

N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride (PubChem CID 120714929) has the molecular formula C12H26ClN3O2S and a molecular weight of 311.88 g/mol. Its IUPAC name is N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride
PubChem CID120714929
Molecular FormulaC12H26ClN3O2S
Molecular Weight311.88 g/mol
Exact Mass311.14
IUPAC NameN-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride
SMILESCNC1CCCN(S(=O)(=O)N2CCCCC2C)C1.Cl
InChIInChI=1S/C12H25N3O2S.ClH/c1-11-6-3-4-9-15(11)18(16,17)14-8-5-7-12(10-14)13-2;/h11-13H,3-10H2,1-2H3;1H
InChIKeyIZUKDHRTRUHXFW-UHFFFAOYSA-N
XLogP1.21
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.88
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-1-piperidin-1-ylsulfonylpiperidine
CID 60723774
1-[1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-yl]ethanamine
CID 63854362
1-(2-methylpiperidin-1-yl)sulfonylpiperidine-3-carbaldehyde
CID 55258735
1-[3-(2-bromoethyl)piperidin-1-yl]sulfonyl-2-methylpiperidine
CID 80673852
[1-(2-methylpiperidin-1-yl)sulfonylpyrrolidin-3-yl]methanamine;hydrochloride
CID 119972063
N-(cyclopropylmethyl)-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-4-amine;hydrochloride
CID 119987691
1-methyl-4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-1,4-diazepane
CID 94021502
(3S)-1-ethylsulfonyl-N-methylpiperidin-3-amine
CID 94476004
ethyl (3R)-1-(2-methylpiperidin-1-yl)sulfonylpiperidine-3-carboxylate
CID 81308957
1-[1-(2-methylpiperidin-1-yl)sulfonylpyrrolidin-3-yl]ethanamine
CID 113360742
N-[[1-(2-methylpiperidin-1-yl)sulfonylpiperidin-4-yl]methyl]cyclopropanamine
CID 63855296
1-(cyclohexylmethylsulfonyl)-N-methylpiperidin-3-amine;hydrochloride
CID 120715396

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride?
The IUPAC name of N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride (CID 120714929) is N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride.
What is the SMILES notation for N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride?
The canonical SMILES for N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride is CNC1CCCN(S(=O)(=O)N2CCCCC2C)C1.Cl.
What is the InChIKey of N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride?
The InChIKey is IZUKDHRTRUHXFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S.ClH/c1-11-6-3-4-9-15(11)18(16,17)14-8-5-7-12(10-14)13-2;/h11-13H,3-10H2,1-2H3;1H.
What are the key properties of N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride?
N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride has a molecular weight of 311.88 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-3-amine;hydrochloride is sourced from PubChem (CID 120714929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).