2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol

C12H18N2O3S — CID 102869029

IUPAC2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol
SMILESCS(=O)(=O)c1cccnc1N(CCO)C1CCC1
InChIInChI=1S/C12H18N2O3S/c1-18(16,17)11-6-3-7-13-12(11)14(8-9-15)10-4-2-5-10/h3,6-7,10,15H,2,4-5,8-9H2,1H3
InChIKeyKJLKHOJEKIOPAZ-UHFFFAOYSA-N
MW270.35 g/mol
LogP0.84
Rot. Bonds5

About 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol

2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol (PubChem CID 102869029) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol
PubChem CID102869029
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol
SMILESCS(=O)(=O)c1cccnc1N(CCO)C1CCC1
InChIInChI=1S/C12H18N2O3S/c1-18(16,17)11-6-3-7-13-12(11)14(8-9-15)10-4-2-5-10/h3,6-7,10,15H,2,4-5,8-9H2,1H3
InChIKeyKJLKHOJEKIOPAZ-UHFFFAOYSA-N
XLogP0.84
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol 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-[cyclobutyl-(3-methoxy-2-pyridinyl)amino]ethanol
CID 102869021
2-[cyclohexyl(2-hydroxyethyl)amino]pyridine-3-carbaldehyde
CID 114055510
1-[2-[cyclobutyl(2-hydroxyethyl)amino]-3-pyridinyl]ethanol
CID 114056274
2-[cyclopentyl-(3-nitro-2-pyridinyl)amino]ethanol
CID 54998817
N-cyclopropyl-3-methylsulfonyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
CID 106641204
1-[2-[cyclobutyl(3-hydroxypropyl)amino]-3-pyridinyl]ethanone
CID 114055612
3-[cyclobutyl-[3-(hydroxymethyl)-2-pyridinyl]amino]propan-1-ol
CID 102869240
2-(2-amino-N-cyclopropyl-3-methylsulfonylanilino)ethanol
CID 82002580
N-methyl-N-(3-methylsulfonyl-2-pyridinyl)azepan-4-amine
CID 107174187
2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxylic acid
CID 102863145
3-[cyclopentyl(2-hydroxyethyl)sulfamoyl]pyridine-2-carbothioamide
CID 106596988
N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 114599260

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol?
The IUPAC name of 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol (CID 102869029) is 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol is CS(=O)(=O)c1cccnc1N(CCO)C1CCC1.
What is the InChIKey of 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol?
The InChIKey is KJLKHOJEKIOPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-18(16,17)11-6-3-7-13-12(11)14(8-9-15)10-4-2-5-10/h3,6-7,10,15H,2,4-5,8-9H2,1H3.
What are the key properties of 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol?
2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol has a molecular weight of 270.35 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-(3-methylsulfonyl-2-pyridinyl)amino]ethanol is sourced from PubChem (CID 102869029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).