2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine

C15H23NOS — CID 64658501

IUPAC2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine
SMILESCCNC1CCCC1S(=O)c1cc(C)ccc1C
InChIInChI=1S/C15H23NOS/c1-4-16-13-6-5-7-14(13)18(17)15-10-11(2)8-9-12(15)3/h8-10,13-14,16H,4-7H2,1-3H3
InChIKeyGOXGCWNWUCBQCA-UHFFFAOYSA-N
MW265.42 g/mol
LogP2.94
Rot. Bonds4

About 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine

2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine (PubChem CID 64658501) has the molecular formula C15H23NOS and a molecular weight of 265.42 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine
PubChem CID64658501
Molecular FormulaC15H23NOS
Molecular Weight265.42 g/mol
Exact Mass265.15
IUPAC Name2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine
SMILESCCNC1CCCC1S(=O)c1cc(C)ccc1C
InChIInChI=1S/C15H23NOS/c1-4-16-13-6-5-7-14(13)18(17)15-10-11(2)8-9-12(15)3/h8-10,13-14,16H,4-7H2,1-3H3
InChIKeyGOXGCWNWUCBQCA-UHFFFAOYSA-N
XLogP2.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.42
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dimethylphenyl)sulfinyl-N-methylcycloheptan-1-amine
CID 64660066
N-ethyl-2-(2-methylphenyl)sulfinylcycloheptan-1-amine
CID 64656783
2-(2,4-dimethylphenyl)sulfinyl-N,4-diethylcyclohexan-1-amine
CID 64659873
[2-(2,5-dimethylphenyl)sulfinylcyclohexyl]methanamine
CID 81328814
2-(2,5-dichlorophenyl)sulfinyl-N-ethylcyclopentan-1-amine
CID 64657347
3-(2,5-dimethylphenyl)sulfinyl-N-propylcyclohexan-1-amine
CID 64716954
N-ethyl-2-[(3-methylphenyl)methylsulfinyl]cyclohexan-1-amine
CID 64658404
2-(4-tert-butylphenyl)sulfinyl-N-ethylcyclopentan-1-amine
CID 64652199
2-(3-chlorophenyl)sulfinyl-N-ethylcyclopentan-1-amine
CID 64659353
2-(2,3-dihydro-1H-inden-5-ylsulfinyl)-N-ethylcyclopentan-1-amine
CID 64653023
5-(2,5-dimethylphenyl)sulfinyl-2,2-dimethylcyclopentan-1-amine
CID 79863463
N-ethyl-2-propylsulfinylcyclopentan-1-amine
CID 64653812

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine?
The IUPAC name of 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine (CID 64658501) is 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine?
The canonical SMILES for 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine is CCNC1CCCC1S(=O)c1cc(C)ccc1C.
What is the InChIKey of 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine?
The InChIKey is GOXGCWNWUCBQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NOS/c1-4-16-13-6-5-7-14(13)18(17)15-10-11(2)8-9-12(15)3/h8-10,13-14,16H,4-7H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine?
2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine has a molecular weight of 265.42 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)sulfinyl-N-ethylcyclopentan-1-amine is sourced from PubChem (CID 64658501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).