(1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine

C11H22N2O2S — CID 63765247

IUPAC(1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine
SMILESNCC1CCCN1S(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H22N2O2S/c12-9-10-5-4-8-13(10)16(14,15)11-6-2-1-3-7-11/h10-11H,1-9,12H2
InChIKeyMGXNHGWMLMVZPW-UHFFFAOYSA-N
MW246.38 g/mol
LogP1.07
Rot. Bonds3

About (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine

(1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine (PubChem CID 63765247) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine.

Molecular Properties

Compound Name(1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine
PubChem CID63765247
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC Name(1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine
SMILESNCC1CCCN1S(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H22N2O2S/c12-9-10-5-4-8-13(10)16(14,15)11-6-2-1-3-7-11/h10-11H,1-9,12H2
InChIKeyMGXNHGWMLMVZPW-UHFFFAOYSA-N
XLogP1.07
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(azepan-1-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride
CID 119969168
(1-cyclopentylsulfonyl-4-ethylpiperidin-2-yl)methanamine
CID 103352691
(1-tert-butylsulfonylpyrrolidin-2-yl)methanamine
CID 63767722
2-(chloromethyl)-1-cyclopropylsulfonylpiperidine
CID 64552452
2-(aminomethyl)-N-cyclohexyl-N-methylpiperidine-1-sulfonamide;hydrochloride
CID 119969104
[1-(oxolan-2-ylmethylsulfonyl)azepan-2-yl]methanamine
CID 116640178
[1-(3-fluoropropylsulfonyl)piperidin-2-yl]methanamine;hydrochloride
CID 119969134
(2S)-1-cyclohexylsulfonylpyrrolidine-2-carboxylic acid
CID 61137595
1-(1-cyclopropylsulfonylpyrrolidin-2-yl)propan-2-one
CID 79546790
[(2S)-1-(2,5-difluoro-4-methylphenyl)sulfonylpyrrolidin-2-yl]methanamine
CID 124695565
2-(aminomethyl)-N-(2,2-difluoroethyl)piperidine-1-sulfonamide
CID 115409106
[(2S)-1-(3,5-dichlorophenyl)sulfonylpyrrolidin-2-yl]methanamine
CID 124573759

Frequently Asked Questions

What is the IUPAC name of (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine?
The IUPAC name of (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine (CID 63765247) is (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine.
What is the SMILES notation for (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine?
The canonical SMILES for (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine is NCC1CCCN1S(=O)(=O)C1CCCCC1.
What is the InChIKey of (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine?
The InChIKey is MGXNHGWMLMVZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c12-9-10-5-4-8-13(10)16(14,15)11-6-2-1-3-7-11/h10-11H,1-9,12H2.
What are the key properties of (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine?
(1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine has a molecular weight of 246.38 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclohexylsulfonylpyrrolidin-2-yl)methanamine is sourced from PubChem (CID 63765247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).