N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine

C10H17NS2 — CID 65131483

IUPACN-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine
SMILESCNC(CSC(C)C)c1cccs1
InChIInChI=1S/C10H17NS2/c1-8(2)13-7-9(11-3)10-5-4-6-12-10/h4-6,8-9,11H,7H2,1-3H3
InChIKeyFTCOULNNZVFKNY-UHFFFAOYSA-N
MW215.39 g/mol
LogP3.15
Rot. Bonds5

About N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine

N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine (PubChem CID 65131483) has the molecular formula C10H17NS2 and a molecular weight of 215.39 g/mol. Its IUPAC name is N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine
PubChem CID65131483
Molecular FormulaC10H17NS2
Molecular Weight215.39 g/mol
Exact Mass215.08
IUPAC NameN-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine
SMILESCNC(CSC(C)C)c1cccs1
InChIInChI=1S/C10H17NS2/c1-8(2)13-7-9(11-3)10-5-4-6-12-10/h4-6,8-9,11H,7H2,1-3H3
InChIKeyFTCOULNNZVFKNY-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.39
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-methylsulfonyl-1-thiophen-2-ylethanamine
CID 62473459
N-methyl-1-propan-2-ylsulfanyl-4-thiophen-2-ylbutan-2-amine
CID 65131658
N-methyl-2-pyridin-4-yl-1-thiophen-2-ylethanamine
CID 62552109
N',N'-diethyl-N-methyl-1-thiophen-2-ylpropane-1,3-diamine
CID 79086941
N-methyl-2-phenoxy-1-thiophen-2-ylethanamine
CID 62715336
2-(2-bromophenyl)-N-methyl-1-thiophen-2-ylethanamine
CID 60818795
N-methyl-4-methylsulfonyl-1-thiophen-2-ylbutan-1-amine
CID 63192027
N-(2-fluoro-1-thiophen-2-ylethyl)propan-2-amine
CID 83817718
N-methyl-3-piperazin-1-yl-1-thiophen-2-ylbutan-1-amine
CID 116960914
2-propan-2-ylthiophene
CID 178128598
2-[2-(methylamino)-2-thiophen-2-ylethyl]aniline;dihydrochloride
CID 22414400
3-(2,2-difluoroethoxy)-N-methyl-1-thiophen-2-ylpropan-1-amine
CID 103149216

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine?
The IUPAC name of N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine (CID 65131483) is N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine.
What is the SMILES notation for N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine?
The canonical SMILES for N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine is CNC(CSC(C)C)c1cccs1.
What is the InChIKey of N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine?
The InChIKey is FTCOULNNZVFKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS2/c1-8(2)13-7-9(11-3)10-5-4-6-12-10/h4-6,8-9,11H,7H2,1-3H3.
What are the key properties of N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine?
N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine has a molecular weight of 215.39 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propan-2-ylsulfanyl-1-thiophen-2-ylethanamine is sourced from PubChem (CID 65131483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).