(1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine

C15H18N2O2S — CID 62063398

IUPAC(1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine
SMILESNCC1CCN(S(=O)(=O)c2ccc3ccccc3c2)C1
InChIInChI=1S/C15H18N2O2S/c16-10-12-7-8-17(11-12)20(18,19)15-6-5-13-3-1-2-4-14(13)9-15/h1-6,9,12H,7-8,10-11,16H2
InChIKeyGONPQZUBPASZSZ-UHFFFAOYSA-N
MW290.39 g/mol
LogP1.81
Rot. Bonds3

About (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine

(1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine (PubChem CID 62063398) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound Name(1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine
PubChem CID62063398
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name(1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine
SMILESNCC1CCN(S(=O)(=O)c2ccc3ccccc3c2)C1
InChIInChI=1S/C15H18N2O2S/c16-10-12-7-8-17(11-12)20(18,19)15-6-5-13-3-1-2-4-14(13)9-15/h1-6,9,12H,7-8,10-11,16H2
InChIKeyGONPQZUBPASZSZ-UHFFFAOYSA-N
XLogP1.81
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-naphthalen-2-ylsulfonylpyrrolidin-3-amine;hydrochloride
CID 119993487
3-butyl-1-naphthalen-2-ylsulfonylpyrrolidine
CID 70948532
3-naphthalen-2-ylsulfonyl-3,9-diazabicyclo[4.2.1]nonane
CID 119989319
[1-(3-chlorophenyl)sulfonylpyrrolidin-3-yl]methanamine;hydrochloride
CID 119971921
N-methyl-1-naphthalen-2-ylsulfonylpyrrolidin-3-amine;hydrochloride
CID 119963029
[1-(3-chloro-4-fluorophenyl)sulfonylpyrrolidin-3-yl]methanamine
CID 55030275
[1-(4-bromo-3-fluorophenyl)sulfonylpyrrolidin-3-yl]methanamine
CID 103828949
[1-(4-chlorophenyl)sulfonylpyrrolidin-3-yl]methanamine;hydrochloride
CID 119971833
2-[methyl-[(3R)-1-naphthalen-2-ylsulfonylpyrrolidin-3-yl]amino]ethanol
CID 143369570
1-naphthalen-2-ylsulfonyl-4-phenylpiperidine
CID 4729267
[1-(4-ethylphenyl)sulfonylpyrrolidin-3-yl]methanamine
CID 55030896
1-naphthalen-2-ylsulfonylpyrrolidine
CID 819722

Frequently Asked Questions

What is the IUPAC name of (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine?
The IUPAC name of (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine (CID 62063398) is (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine?
The canonical SMILES for (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine is NCC1CCN(S(=O)(=O)c2ccc3ccccc3c2)C1.
What is the InChIKey of (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine?
The InChIKey is GONPQZUBPASZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c16-10-12-7-8-17(11-12)20(18,19)15-6-5-13-3-1-2-4-14(13)9-15/h1-6,9,12H,7-8,10-11,16H2.
What are the key properties of (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine?
(1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine has a molecular weight of 290.39 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-naphthalen-2-ylsulfonylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 62063398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).