N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine

C11H24N2O2S — CID 63761677

IUPACN'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine
SMILESCCS(=O)(=O)CCN(CCN)C1CCCC1
InChIInChI=1S/C11H24N2O2S/c1-2-16(14,15)10-9-13(8-7-12)11-5-3-4-6-11/h11H,2-10,12H2,1H3
InChIKeySKCDWGNQTZRHRE-UHFFFAOYSA-N
MW248.39 g/mol
LogP0.62
Rot. Bonds7

About N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine

N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine (PubChem CID 63761677) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine
PubChem CID63761677
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine
SMILESCCS(=O)(=O)CCN(CCN)C1CCCC1
InChIInChI=1S/C11H24N2O2S/c1-2-16(14,15)10-9-13(8-7-12)11-5-3-4-6-11/h11H,2-10,12H2,1H3
InChIKeySKCDWGNQTZRHRE-UHFFFAOYSA-N
XLogP0.62
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-cyclohexyl-N'-propylethane-1,2-diamine
CID 61348599
N-(2-bromoethyl)-N-(2-propylsulfonylethyl)cyclopentanamine
CID 106731144
N-(2-bromoethyl)-N-(2-propylsulfonylethyl)cyclobutanamine
CID 106731454
N'-cyclohexyl-N'-hexylethane-1,2-diamine
CID 63760462
2-[2-aminoethyl(cyclohexyl)amino]-N,N-diethylacetamide
CID 63760461
2-[2-aminoethyl(cycloheptyl)amino]acetic acid
CID 117013481
N-(2-aminoethyl)-N-cyclobutylethanesulfonamide
CID 102874418
N'-butyl-N'-cyclopropylethane-1,2-diamine
CID 61349574
4-[2-aminoethyl(cyclopentyl)amino]-N,N-dimethylbutanamide
CID 63759502
2-[2-aminoethyl(cyclohexyl)amino]-N-pentan-3-ylacetamide
CID 63760267
N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine
CID 104561146
N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine
CID 112591848

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine (CID 63761677) is N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine is CCS(=O)(=O)CCN(CCN)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine?
The InChIKey is SKCDWGNQTZRHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-2-16(14,15)10-9-13(8-7-12)11-5-3-4-6-11/h11H,2-10,12H2,1H3.
What are the key properties of N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine?
N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine has a molecular weight of 248.39 g/mol, XLogP of 0.62, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(2-ethylsulfonylethyl)ethane-1,2-diamine is sourced from PubChem (CID 63761677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).