2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine

C12H19NOS — CID 116722511

IUPAC2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine
SMILESCCNC(c1ccsc1)C(OC)C1CC1
InChIInChI=1S/C12H19NOS/c1-3-13-11(10-6-7-15-8-10)12(14-2)9-4-5-9/h6-9,11-13H,3-5H2,1-2H3
InChIKeyMMGJORSAWGDGMO-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.82
Rot. Bonds6

About 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine

2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine (PubChem CID 116722511) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine
PubChem CID116722511
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine
SMILESCCNC(c1ccsc1)C(OC)C1CC1
InChIInChI=1S/C12H19NOS/c1-3-13-11(10-6-7-15-8-10)12(14-2)9-4-5-9/h6-9,11-13H,3-5H2,1-2H3
InChIKeyMMGJORSAWGDGMO-UHFFFAOYSA-N
XLogP2.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine
CID 116722222
1-(4-tert-butylphenyl)-2-cyclopropyl-N-ethyl-2-methoxyethanamine
CID 116722412
2-cyclopropyl-2-methoxy-1-thiophen-3-ylethanol
CID 116712674
N-ethyl-2-methoxy-1-thiophen-3-ylpentan-1-amine
CID 116719131
2-cyclopropyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-2-methoxyethanamine
CID 116722579
2-cyclopropyl-N-ethyl-2-methoxy-1-[3-(2-methylpropyl)phenyl]ethanamine
CID 116722482
2-cyclohexyl-1-(3,4-dimethylphenyl)-N-ethyl-2-methoxyethanamine
CID 116771781
2-cyclopropyl-N-ethyl-2-methoxy-1-quinolin-3-ylethanamine
CID 116722411
(2-cyclohexyl-2-ethoxy-1-thiophen-3-ylethyl)hydrazine
CID 105278800
N-[2-cyclopropyl-2-methoxy-1-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 116722720
2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine
CID 116771802
N-[1-(4-chlorophenyl)-2-cyclopropyl-2-methoxyethyl]propan-1-amine
CID 116722802

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine?
The IUPAC name of 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine (CID 116722511) is 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine.
What is the SMILES notation for 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine?
The canonical SMILES for 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine is CCNC(c1ccsc1)C(OC)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine?
The InChIKey is MMGJORSAWGDGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-3-13-11(10-6-7-15-8-10)12(14-2)9-4-5-9/h6-9,11-13H,3-5H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine?
2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine has a molecular weight of 225.36 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine is sourced from PubChem (CID 116722511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).