2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine

C14H27NO2S — CID 79863455

IUPAC2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine
SMILESCC1CCCC(S(=O)(=O)C2CCC(C)(C)C2N)C1
InChIInChI=1S/C14H27NO2S/c1-10-5-4-6-11(9-10)18(16,17)12-7-8-14(2,3)13(12)15/h10-13H,4-9,15H2,1-3H3
InChIKeyGKSVXUWWBVBPPA-UHFFFAOYSA-N
MW273.44 g/mol
LogP2.50
Rot. Bonds2

About 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine

2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine (PubChem CID 79863455) has the molecular formula C14H27NO2S and a molecular weight of 273.44 g/mol. Its IUPAC name is 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine
PubChem CID79863455
Molecular FormulaC14H27NO2S
Molecular Weight273.44 g/mol
Exact Mass273.18
IUPAC Name2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine
SMILESCC1CCCC(S(=O)(=O)C2CCC(C)(C)C2N)C1
InChIInChI=1S/C14H27NO2S/c1-10-5-4-6-11(9-10)18(16,17)12-7-8-14(2,3)13(12)15/h10-13H,4-9,15H2,1-3H3
InChIKeyGKSVXUWWBVBPPA-UHFFFAOYSA-N
XLogP2.50
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.44
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclohexylsulfonyl-2,2-dimethylcyclopentan-1-amine
CID 79863453
4-methyl-2-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64676428
4-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 55115171
2,2-dimethyl-5-methylsulfonylcyclopentan-1-amine
CID 79863440
N-methyl-3-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64717554
N-[(2-amino-3,3-dimethylcyclopentyl)methyl]-N,3-dimethylcyclohexan-1-amine
CID 79866338
N-ethyl-4-methyl-2-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64675834
N-methyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine
CID 64676036
4-(3-methylcyclohexyl)sulfonylpiperidine;hydrochloride
CID 162106745
[2-(3-methylcyclohexyl)sulfonyl-4-propylcyclohexyl]methanamine
CID 64696403
2,2-dimethyl-6-methylsulfonylcyclohexan-1-amine
CID 79847216
N-methyl-3-(3-methylcyclohexyl)sulfonylpropan-1-amine
CID 64676229

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine?
The IUPAC name of 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine (CID 79863455) is 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine.
What is the SMILES notation for 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine?
The canonical SMILES for 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine is CC1CCCC(S(=O)(=O)C2CCC(C)(C)C2N)C1.
What is the InChIKey of 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine?
The InChIKey is GKSVXUWWBVBPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2S/c1-10-5-4-6-11(9-10)18(16,17)12-7-8-14(2,3)13(12)15/h10-13H,4-9,15H2,1-3H3.
What are the key properties of 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine?
2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine has a molecular weight of 273.44 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-(3-methylcyclohexyl)sulfonylcyclopentan-1-amine is sourced from PubChem (CID 79863455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).