N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine

C11H17N3O2S — CID 114599260

IUPACN-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCN(c1ncccc1S(C)(=O)=O)C1CCNC1
InChIInChI=1S/C11H17N3O2S/c1-14(9-5-7-12-8-9)11-10(17(2,15)16)4-3-6-13-11/h3-4,6,9,12H,5,7-8H2,1-2H3
InChIKeyVVYSTRXMLNJRQF-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.28
Rot. Bonds3

About N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine

N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 114599260) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound NameN-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine
PubChem CID114599260
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC NameN-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCN(c1ncccc1S(C)(=O)=O)C1CCNC1
InChIInChI=1S/C11H17N3O2S/c1-14(9-5-7-12-8-9)11-10(17(2,15)16)4-3-6-13-11/h3-4,6,9,12H,5,7-8H2,1-2H3
InChIKeyVVYSTRXMLNJRQF-UHFFFAOYSA-N
XLogP0.28
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 174664451
N-methyl-2-[methyl(pyrrolidin-3-yl)amino]benzenesulfonamide
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N-methyl-3-methylsulfonyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
CID 106642245
N-methyl-N-piperidin-3-yl-3-(trifluoromethyl)pyridin-2-amine;dihydrochloride
CID 146077841
N-cyclopropyl-3-methylsulfonyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
CID 106641204
2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol
CID 102869029
N,5,6-trimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83833515
N-methyl-N-pyrrolidin-3-ylpyridine-3-sulfonamide
CID 63297947
N,3-dimethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
CID 55205906
N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine
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N-methyl-N-[(3R)-pyrrolidin-3-yl]-1,2-benzothiazol-3-amine;hydrochloride
CID 71641030

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine (CID 114599260) is N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine is CN(c1ncccc1S(C)(=O)=O)C1CCNC1.
What is the InChIKey of N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is VVYSTRXMLNJRQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-14(9-5-7-12-8-9)11-10(17(2,15)16)4-3-6-13-11/h3-4,6,9,12H,5,7-8H2,1-2H3.
What are the key properties of N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine?
N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine has a molecular weight of 255.34 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 114599260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).