(3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine

C10H21N3O2S — CID 94340323

IUPAC(3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine
SMILESCC1CCN(S(=O)(=O)N2CC[C@H](N)C2)CC1
InChIInChI=1S/C10H21N3O2S/c1-9-2-5-12(6-3-9)16(14,15)13-7-4-10(11)8-13/h9-10H,2-8,11H2,1H3/t10-/m0/s1
InChIKeyPRRBDMHWCOLMMB-JTQLQIEISA-N
MW247.36 g/mol
LogP-0.00
Rot. Bonds2

About (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine

(3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine (PubChem CID 94340323) has the molecular formula C10H21N3O2S and a molecular weight of 247.36 g/mol. Its IUPAC name is (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine
PubChem CID94340323
Molecular FormulaC10H21N3O2S
Molecular Weight247.36 g/mol
Exact Mass247.14
IUPAC Name(3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine
SMILESCC1CCN(S(=O)(=O)N2CC[C@H](N)C2)CC1
InChIInChI=1S/C10H21N3O2S/c1-9-2-5-12(6-3-9)16(14,15)13-7-4-10(11)8-13/h9-10H,2-8,11H2,1H3/t10-/m0/s1
InChIKeyPRRBDMHWCOLMMB-JTQLQIEISA-N
XLogP-0.00
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-4-methylpiperidine-1-sulfonamide
CID 43053240
4-methyl-N-(3-methylbutan-2-yl)piperidine-1-sulfonamide
CID 43053258
(3R*,4S*)-3-amino-N-ethyl-N-methyl-4-propyl-1-pyrrolidinesulfonamide
CID 72885954
N-(4-methyl-4-piperidinyl)-1-pyrrolidinesulfonamide hydrochloride
CID 114696701
N-[[(2R)-1-methylpiperidin-2-yl]methyl]pyrrolidine-1-sulfonamide
CID 164642520
1-[(2S,4S)-4-fluoro-1-(3-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]-N-methylmethanamine
CID 132355566
1-[(2S,4S)-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-fluoropyrrolidin-2-yl]-N-methylmethanamine
CID 132355567
4-Methyl-2-(2-piperidin-4-ylpropyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 20434878
2-(Piperidin-4-ylmethyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 20434881
2-[2-(4-Piperidyl)ethyl]-4-methyl-1,2,5-thiadiazolidine-1,1-dioxide
CID 20434886
2-[2-(4-Piperidyl)ethyl]-3-methyl-1,2,5-thiadiazolidine-1,1-dioxide
CID 20434889
2-(2-Piperidin-4-ylethyl)-1,2,5-thiadiazolidine 1,1-dioxide;hydrochloride
CID 20434918

Frequently Asked Questions

What is the IUPAC name of (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine?
The IUPAC name of (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine (CID 94340323) is (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine.
What is the SMILES notation for (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine?
The canonical SMILES for (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine is CC1CCN(S(=O)(=O)N2CC[C@H](N)C2)CC1.
What is the InChIKey of (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine?
The InChIKey is PRRBDMHWCOLMMB-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21N3O2S/c1-9-2-5-12(6-3-9)16(14,15)13-7-4-10(11)8-13/h9-10H,2-8,11H2,1H3/t10-/m0/s1.
What are the key properties of (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine?
(3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine has a molecular weight of 247.36 g/mol, XLogP of -0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine is sourced from PubChem (CID 94340323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).