N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine

C16H21NOS — CID 116773126

IUPACN-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine
SMILESCCNC(Cc1ccsc1)C(OC)c1ccccc1
InChIInChI=1S/C16H21NOS/c1-3-17-15(11-13-9-10-19-12-13)16(18-2)14-7-5-4-6-8-14/h4-10,12,15-17H,3,11H2,1-2H3
InChIKeyJSNXVCXORICJRQ-UHFFFAOYSA-N
MW275.42 g/mol
LogP3.66
Rot. Bonds7

About N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine

N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine (PubChem CID 116773126) has the molecular formula C16H21NOS and a molecular weight of 275.42 g/mol. Its IUPAC name is N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine
PubChem CID116773126
Molecular FormulaC16H21NOS
Molecular Weight275.42 g/mol
Exact Mass275.13
IUPAC NameN-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine
SMILESCCNC(Cc1ccsc1)C(OC)c1ccccc1
InChIInChI=1S/C16H21NOS/c1-3-17-15(11-13-9-10-19-12-13)16(18-2)14-7-5-4-6-8-14/h4-10,12,15-17H,3,11H2,1-2H3
InChIKeyJSNXVCXORICJRQ-UHFFFAOYSA-N
XLogP3.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-chlorophenyl)-N-ethyl-1-methoxy-1-phenylpropan-2-amine
CID 116773119
N-ethyl-1-phenylsulfanyl-3-thiophen-3-ylpropan-2-amine
CID 65143801
N-methyl-3-phenyl-1-thiophen-3-ylpentan-2-amine
CID 115845128
N-ethyl-1-methoxy-3-thiophen-3-ylpropan-2-amine
CID 62604477
2-methyl-1-phenyl-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 104845591
1-(3,5-dimethoxyphenyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 61078732
N-ethyl-1-(3-fluorophenyl)-2-thiophen-3-ylethanamine
CID 61078915
1-ethoxy-N-ethyl-3-(furan-3-yl)-1-phenylpropan-2-amine
CID 116773731
N-ethyl-N'-methyl-1-phenyl-N'-(thiophen-3-ylmethyl)propane-1,3-diamine
CID 62612447
N-ethyl-1-methoxy-1-phenylnon-8-en-2-amine
CID 107009776
N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine
CID 63078464
N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)-2-phenylethanamine
CID 116773182

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine?
The IUPAC name of N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine (CID 116773126) is N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine?
The canonical SMILES for N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine is CCNC(Cc1ccsc1)C(OC)c1ccccc1.
What is the InChIKey of N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine?
The InChIKey is JSNXVCXORICJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NOS/c1-3-17-15(11-13-9-10-19-12-13)16(18-2)14-7-5-4-6-8-14/h4-10,12,15-17H,3,11H2,1-2H3.
What are the key properties of N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine?
N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine has a molecular weight of 275.42 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methoxy-1-phenyl-3-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 116773126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).