1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide

C14H22N2O2S — CID 125447729

IUPAC1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide
SMILESCc1cccnc1[C@@H](C)NS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H22N2O2S/c1-11-6-5-9-15-14(11)12(2)16-19(17,18)10-13-7-3-4-8-13/h5-6,9,12-13,16H,3-4,7-8,10H2,1-2H3/t12-/m1/s1
InChIKeyZFXJAZHFOXZKFI-GFCCVEGCSA-N
MW282.41 g/mol
LogP2.56
Rot. Bonds5

About 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide

1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide (PubChem CID 125447729) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide
PubChem CID125447729
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC Name1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide
SMILESCc1cccnc1[C@@H](C)NS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H22N2O2S/c1-11-6-5-9-15-14(11)12(2)16-19(17,18)10-13-7-3-4-8-13/h5-6,9,12-13,16H,3-4,7-8,10H2,1-2H3/t12-/m1/s1
InChIKeyZFXJAZHFOXZKFI-GFCCVEGCSA-N
XLogP2.56
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide?
The IUPAC name of 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide (CID 125447729) is 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide?
The canonical SMILES for 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide is Cc1cccnc1[C@@H](C)NS(=O)(=O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide?
The InChIKey is ZFXJAZHFOXZKFI-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-11-6-5-9-15-14(11)12(2)16-19(17,18)10-13-7-3-4-8-13/h5-6,9,12-13,16H,3-4,7-8,10H2,1-2H3/t12-/m1/s1.
What are the key properties of 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide?
1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide has a molecular weight of 282.41 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]methanesulfonamide is sourced from PubChem (CID 125447729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).