N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine

C12H21NOS — CID 62355435

IUPACN-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine
SMILESCCNCC(C)(C)OCCc1cccs1
InChIInChI=1S/C12H21NOS/c1-4-13-10-12(2,3)14-8-7-11-6-5-9-15-11/h5-6,9,13H,4,7-8,10H2,1-3H3
InChIKeyXSATUBIJOZGNNM-UHFFFAOYSA-N
MW227.37 g/mol
LogP2.70
Rot. Bonds7

About N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine

N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine (PubChem CID 62355435) has the molecular formula C12H21NOS and a molecular weight of 227.37 g/mol. Its IUPAC name is N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine
PubChem CID62355435
Molecular FormulaC12H21NOS
Molecular Weight227.37 g/mol
Exact Mass227.13
IUPAC NameN-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine
SMILESCCNCC(C)(C)OCCc1cccs1
InChIInChI=1S/C12H21NOS/c1-4-13-10-12(2,3)14-8-7-11-6-5-9-15-11/h5-6,9,13H,4,7-8,10H2,1-3H3
InChIKeyXSATUBIJOZGNNM-UHFFFAOYSA-N
XLogP2.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,2-dimethyl-4-thiophen-2-ylbutan-1-amine
CID 63774462
2-(2-methylbutan-2-yloxy)-N-(thiophen-2-ylmethyl)ethanamine
CID 62597441
N-ethyl-3-(2-thiophen-2-ylethoxy)propan-1-amine
CID 62485827
N-ethyl-2-methyl-2-(2-phenoxyethoxy)propan-1-amine
CID 62353597
N-[[3-(2-thiophen-2-ylethoxy)phenyl]methyl]ethanamine
CID 63776029
methyl 2,2-dimethyl-3-(2-thiophen-2-ylethylamino)propanoate
CID 79629616
N-ethyl-2,2-dimethyl-N'-propan-2-yl-N'-(thiophen-2-ylmethyl)propane-1,3-diamine
CID 62258772
N-ethyl-3-methoxy-2-(2-thiophen-2-ylethoxy)propan-1-amine
CID 103228622
N-[[3-fluoro-4-(2-thiophen-2-ylethoxy)phenyl]methyl]ethanamine
CID 107686825
N-ethyl-6-thiophen-2-ylhexan-1-amine
CID 65308427
N-[[5-chloro-6-(2-thiophen-2-ylethoxy)-3-pyridinyl]methyl]ethanamine
CID 62323331
N-[[5-(2-thiophen-2-ylethoxymethyl)furan-3-yl]methyl]ethanamine
CID 62486002

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine?
The IUPAC name of N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine (CID 62355435) is N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine is CCNCC(C)(C)OCCc1cccs1.
What is the InChIKey of N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine?
The InChIKey is XSATUBIJOZGNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NOS/c1-4-13-10-12(2,3)14-8-7-11-6-5-9-15-11/h5-6,9,13H,4,7-8,10H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine?
N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine has a molecular weight of 227.37 g/mol, XLogP of 2.70, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2-(2-thiophen-2-ylethoxy)propan-1-amine is sourced from PubChem (CID 62355435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).