2-(2-propylsulfonylethoxy)cyclohexan-1-amine

C11H23NO3S — CID 106726998

IUPAC2-(2-propylsulfonylethoxy)cyclohexan-1-amine
SMILESCCCS(=O)(=O)CCOC1CCCCC1N
InChIInChI=1S/C11H23NO3S/c1-2-8-16(13,14)9-7-15-11-6-4-3-5-10(11)12/h10-11H,2-9,12H2,1H3
InChIKeyHAQPJFUVCAYRHV-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.10
Rot. Bonds6

About 2-(2-propylsulfonylethoxy)cyclohexan-1-amine

2-(2-propylsulfonylethoxy)cyclohexan-1-amine (PubChem CID 106726998) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is 2-(2-propylsulfonylethoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(2-propylsulfonylethoxy)cyclohexan-1-amine
PubChem CID106726998
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC Name2-(2-propylsulfonylethoxy)cyclohexan-1-amine
SMILESCCCS(=O)(=O)CCOC1CCCCC1N
InChIInChI=1S/C11H23NO3S/c1-2-8-16(13,14)9-7-15-11-6-4-3-5-10(11)12/h10-11H,2-9,12H2,1H3
InChIKeyHAQPJFUVCAYRHV-UHFFFAOYSA-N
XLogP1.10
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-butoxycyclohexan-1-amine
CID 43267617
2-octoxycyclohexan-1-amine
CID 43127889
2-(2-propoxyethoxy)cycloheptan-1-amine
CID 63685616
2-hexoxycyclododecan-1-amine
CID 43127854
2-(2-ethoxyethoxy)cyclohexan-1-amine
CID 43183919
2-ethoxycyclopentan-1-amine
CID 16792821
2-(2-methoxyethoxy)cyclopentan-1-amine
CID 43184183
2-(3-methoxypropoxy)cyclododecan-1-amine
CID 54936156
2-(3,3-dimethylbutoxy)cyclooctan-1-amine
CID 66232018
2-propylsulfonylcyclohexan-1-amine
CID 64645702
2-(2-propylsulfonylethyl)cyclobutan-1-amine
CID 106735337
3-(2-propylsulfonylethoxy)pyrrolidine
CID 106726895

Frequently Asked Questions

What is the IUPAC name of 2-(2-propylsulfonylethoxy)cyclohexan-1-amine?
The IUPAC name of 2-(2-propylsulfonylethoxy)cyclohexan-1-amine (CID 106726998) is 2-(2-propylsulfonylethoxy)cyclohexan-1-amine.
What is the SMILES notation for 2-(2-propylsulfonylethoxy)cyclohexan-1-amine?
The canonical SMILES for 2-(2-propylsulfonylethoxy)cyclohexan-1-amine is CCCS(=O)(=O)CCOC1CCCCC1N.
What is the InChIKey of 2-(2-propylsulfonylethoxy)cyclohexan-1-amine?
The InChIKey is HAQPJFUVCAYRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-2-8-16(13,14)9-7-15-11-6-4-3-5-10(11)12/h10-11H,2-9,12H2,1H3.
What are the key properties of 2-(2-propylsulfonylethoxy)cyclohexan-1-amine?
2-(2-propylsulfonylethoxy)cyclohexan-1-amine has a molecular weight of 249.38 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propylsulfonylethoxy)cyclohexan-1-amine is sourced from PubChem (CID 106726998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).