N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine

C15H30N2O2S — CID 65047071

IUPACN,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine
SMILESCN(C)C1(CNC2CCCC2S(C)(=O)=O)CCCCC1
InChIInChI=1S/C15H30N2O2S/c1-17(2)15(10-5-4-6-11-15)12-16-13-8-7-9-14(13)20(3,18)19/h13-14,16H,4-12H2,1-3H3
InChIKeyOSRLSARGSXRJLR-UHFFFAOYSA-N
MW302.48 g/mol
LogP1.81
Rot. Bonds5

About N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine

N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine (PubChem CID 65047071) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine
PubChem CID65047071
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC NameN,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine
SMILESCN(C)C1(CNC2CCCC2S(C)(=O)=O)CCCCC1
InChIInChI=1S/C15H30N2O2S/c1-17(2)15(10-5-4-6-11-15)12-16-13-8-7-9-14(13)20(3,18)19/h13-14,16H,4-12H2,1-3H3
InChIKeyOSRLSARGSXRJLR-UHFFFAOYSA-N
XLogP1.81
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-methylcyclopentyl)methyl]-2-methylsulfonylcyclopentan-1-amine
CID 65045704
N-[(1-methylcyclopropyl)methyl]-2-methylsulfonylcyclopentan-1-amine
CID 103914483
N-[(1-ethylcyclopentyl)methyl]-2-methylsulfonylcyclopentan-1-amine
CID 113350840
4-methyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 65115654
1-[[(2-tert-butylcyclohexyl)amino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 43081498
4-[[(2-methylsulfonylcyclopentyl)amino]methyl]oxan-4-ol
CID 81131287
N-(cyclopropylmethyl)-2-methylsulfonylcyclopentan-1-amine
CID 65046998
N-(2,2-difluoroethyl)-2-methylsulfonylcyclopentan-1-amine
CID 115405922
cis-(1R,2S)-N-methyl-2-methylsulfonylcyclopentan-1-amine
CID 94586193
1-[(diethylsulfamoylamino)methyl]-1-(dimethylamino)cycloheptane
CID 34249483
2-[(2-methylsulfonylcyclopentyl)amino]acetamide
CID 65046579
N'-(2-methylsulfonylcyclopentyl)propane-1,3-diamine
CID 65044398

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine (CID 65047071) is N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine is CN(C)C1(CNC2CCCC2S(C)(=O)=O)CCCCC1.
What is the InChIKey of N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is OSRLSARGSXRJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c1-17(2)15(10-5-4-6-11-15)12-16-13-8-7-9-14(13)20(3,18)19/h13-14,16H,4-12H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine?
N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 302.48 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[(2-methylsulfonylcyclopentyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 65047071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).