N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine

C11H23NO2S — CID 64905724

IUPACN-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine
SMILESCCNC1CCC(S(=O)CCOC)C1C
InChIInChI=1S/C11H23NO2S/c1-4-12-10-5-6-11(9(10)2)15(13)8-7-14-3/h9-12H,4-8H2,1-3H3
InChIKeyITAJZWQZGSUBGI-UHFFFAOYSA-N
MW233.38 g/mol
LogP1.16
Rot. Bonds6

About N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine

N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine (PubChem CID 64905724) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine
PubChem CID64905724
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC NameN-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine
SMILESCCNC1CCC(S(=O)CCOC)C1C
InChIInChI=1S/C11H23NO2S/c1-4-12-10-5-6-11(9(10)2)15(13)8-7-14-3/h9-12H,4-8H2,1-3H3
InChIKeyITAJZWQZGSUBGI-UHFFFAOYSA-N
XLogP1.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-methyl-3-pentylsulfinylcyclopentan-1-amine
CID 107758842
N-ethyl-2-(3-methoxypropylsulfinyl)-4-propan-2-ylcyclohexan-1-amine
CID 64659603
N-cyclopropyl-2-[3-(ethylamino)-2-methylcyclopentyl]sulfinylacetamide
CID 114232806
2-[3-(ethylamino)-2-methylcyclopentyl]sulfinyl-N-propylacetamide
CID 114232712
N-ethyl-4-methyl-2-propylsulfinylcyclohexan-1-amine
CID 64652163
3-ethylsulfinyl-N,2-dimethylcyclopentan-1-amine
CID 64905520
2-butylsulfinyl-N-ethyl-4-methylcyclohexan-1-amine
CID 64653897
N-ethyl-2-propylsulfinylcyclopentan-1-amine
CID 64653812
2-(3-methoxypropylsulfinyl)-N-propylcyclopentan-1-amine
CID 64659982
3-(2,5-difluorophenyl)sulfinyl-N-ethyl-2-methylcyclopentan-1-amine
CID 64905728
3-(3-chlorophenyl)sulfinyl-N-ethyl-2-methylcyclopentan-1-amine
CID 64904089
2-(3-methoxypropylsulfinyl)-N-methyl-4-propylcyclohexan-1-amine
CID 64658421

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine?
The IUPAC name of N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine (CID 64905724) is N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine.
What is the SMILES notation for N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine?
The canonical SMILES for N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine is CCNC1CCC(S(=O)CCOC)C1C.
What is the InChIKey of N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine?
The InChIKey is ITAJZWQZGSUBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-4-12-10-5-6-11(9(10)2)15(13)8-7-14-3/h9-12H,4-8H2,1-3H3.
What are the key properties of N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine?
N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine has a molecular weight of 233.38 g/mol, XLogP of 1.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-methoxyethylsulfinyl)-2-methylcyclopentan-1-amine is sourced from PubChem (CID 64905724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).