N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine

C11H23NO2S — CID 107760400

IUPACN-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine
SMILESCNC1CCC(S(=O)(=O)CCC(C)C)C1
InChIInChI=1S/C11H23NO2S/c1-9(2)6-7-15(13,14)11-5-4-10(8-11)12-3/h9-12H,4-8H2,1-3H3
InChIKeyAHVKINWNUPPWLB-UHFFFAOYSA-N
MW233.38 g/mol
LogP1.59
Rot. Bonds5

About N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine

N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine (PubChem CID 107760400) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine
PubChem CID107760400
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC NameN-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine
SMILESCNC1CCC(S(=O)(=O)CCC(C)C)C1
InChIInChI=1S/C11H23NO2S/c1-9(2)6-7-15(13,14)11-5-4-10(8-11)12-3/h9-12H,4-8H2,1-3H3
InChIKeyAHVKINWNUPPWLB-UHFFFAOYSA-N
XLogP1.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(oxan-4-ylsulfonyl)butan-2-amine
CID 64675493
N-propyl-3-propylsulfonylcyclopentan-1-amine
CID 64723445
N-[2-(3-methylbutylsulfonyl)propyl]cyclopropanamine
CID 107757830
N-methyl-1-(3-methylbutylsulfonyl)piperidin-3-amine
CID 63856793
2-(3-methylbutylsulfonyl)cyclopentan-1-one
CID 107767951
N-(4-hydroxycyclohexyl)-3-methylbutane-1-sulfonamide
CID 63856243
N-[2-(3-methylcyclohexyl)sulfonylethyl]propan-2-amine
CID 64675839
1-cyclopentyl-N-methyl-4-propan-2-ylsulfonylbutan-1-amine
CID 106727336
2-methylpropylsulfonylcyclopropane
CID 58333627
4-cyclopentylsulfonylbutan-2-amine
CID 64674097
N-ethyl-3-(2-methylpropylsulfonyl)cyclohexan-1-amine
CID 64715674
N-methyl-3-(oxan-4-ylsulfonyl)cyclohexan-1-amine
CID 64716936

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine?
The IUPAC name of N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine (CID 107760400) is N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine.
What is the SMILES notation for N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine?
The canonical SMILES for N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine is CNC1CCC(S(=O)(=O)CCC(C)C)C1.
What is the InChIKey of N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine?
The InChIKey is AHVKINWNUPPWLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-9(2)6-7-15(13,14)11-5-4-10(8-11)12-3/h9-12H,4-8H2,1-3H3.
What are the key properties of N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine?
N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine has a molecular weight of 233.38 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(3-methylbutylsulfonyl)cyclopentan-1-amine is sourced from PubChem (CID 107760400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).