N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine

C11H19NOS — CID 105155405

IUPACN-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine
SMILESCNC(COC(C)C)c1csc(C)c1
InChIInChI=1S/C11H19NOS/c1-8(2)13-6-11(12-4)10-5-9(3)14-7-10/h5,7-8,11-12H,6H2,1-4H3
InChIKeyBLMQGSOJWWBSSJ-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.74
Rot. Bonds5

About N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine

N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine (PubChem CID 105155405) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine
PubChem CID105155405
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC NameN-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine
SMILESCNC(COC(C)C)c1csc(C)c1
InChIInChI=1S/C11H19NOS/c1-8(2)13-6-11(12-4)10-5-9(3)14-7-10/h5,7-8,11-12H,6H2,1-4H3
InChIKeyBLMQGSOJWWBSSJ-UHFFFAOYSA-N
XLogP2.74
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyl-N-methyl-1-(5-methylthiophen-3-yl)ethanamine
CID 104991619
3-(2,2-difluoroethoxy)-N-methyl-1-(5-methylthiophen-3-yl)propan-1-amine
CID 103149318
N-methyl-1-(5-methylthiophen-3-yl)octan-1-amine
CID 104991616
N-methyl-2-(4-methylphenyl)-1-(5-methylthiophen-3-yl)ethanamine
CID 65104510
1-(4-methoxythiophen-2-yl)-N-methyl-2-propan-2-yloxyethanamine
CID 105013504
2-ethoxy-N,3-dimethyl-1-(5-methylthiophen-3-yl)butan-1-amine
CID 116721090
N-methyl-2-(4-methyl-1,3-thiazol-2-yl)-1-(5-methylthiophen-3-yl)ethanamine
CID 65104686
1-(3-chlorothiophen-2-yl)-N-methyl-2-propan-2-yloxyethanamine
CID 105013001
N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine
CID 105155581
2-(3,4-difluorophenyl)-N-methyl-1-(5-methylthiophen-3-yl)ethanamine
CID 104991463
2-(2-bromophenyl)-N-methyl-1-(5-methylthiophen-3-yl)ethanamine
CID 65105091
1-(3-bromo-5-chlorophenyl)-N-methyl-2-propan-2-yloxyethanamine
CID 107946370

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine?
The IUPAC name of N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine (CID 105155405) is N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine.
What is the SMILES notation for N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine?
The canonical SMILES for N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine is CNC(COC(C)C)c1csc(C)c1.
What is the InChIKey of N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine?
The InChIKey is BLMQGSOJWWBSSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-8(2)13-6-11(12-4)10-5-9(3)14-7-10/h5,7-8,11-12H,6H2,1-4H3.
What are the key properties of N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine?
N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine has a molecular weight of 213.35 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylthiophen-3-yl)-2-propan-2-yloxyethanamine is sourced from PubChem (CID 105155405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).