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

C11H17NOS — CID 116722222

IUPAC2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine
SMILESCNC(c1ccsc1)C(OC)C1CC1
InChIInChI=1S/C11H17NOS/c1-12-10(9-5-6-14-7-9)11(13-2)8-3-4-8/h5-8,10-12H,3-4H2,1-2H3
InChIKeyLSYVKIHVVWZWOM-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.43
Rot. Bonds5

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

2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine (PubChem CID 116722222) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine
PubChem CID116722222
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine
SMILESCNC(c1ccsc1)C(OC)C1CC1
InChIInChI=1S/C11H17NOS/c1-12-10(9-5-6-14-7-9)11(13-2)8-3-4-8/h5-8,10-12H,3-4H2,1-2H3
InChIKeyLSYVKIHVVWZWOM-UHFFFAOYSA-N
XLogP2.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine
CID 116722511
2-cyclopropyl-2-methoxy-1-thiophen-3-ylethanol
CID 116712674
2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine
CID 116722206
1-(4-chloro-3-methoxyphenyl)-2-cyclopropyl-2-methoxy-N-methylethanamine
CID 116722171
2-cyclopropyl-2-methoxy-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine
CID 116722194
2-cyclohexyl-1-(3,4-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771600
1-(2-chlorophenyl)-2-cyclopropyl-2-methoxy-N-methylethanamine
CID 116722168
(2-cyclohexyl-2-ethoxy-1-thiophen-3-ylethyl)hydrazine
CID 105278800
N-methyl-2-(thian-4-yl)-1-thiophen-3-ylethanamine
CID 105153997
N-methyl-1-thiophen-3-yl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105154131
1-cyclopropyl-1-methoxy-4-thiophen-3-ylbutan-2-amine
CID 116722043
1-(4,4-difluorocyclohexyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 105154096

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine?
The IUPAC name of 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine (CID 116722222) is 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine.
What is the SMILES notation for 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine?
The canonical SMILES for 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine is CNC(c1ccsc1)C(OC)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine?
The InChIKey is LSYVKIHVVWZWOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-12-10(9-5-6-14-7-9)11(13-2)8-3-4-8/h5-8,10-12H,3-4H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine?
2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine has a molecular weight of 211.33 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methoxy-N-methyl-1-thiophen-3-ylethanamine is sourced from PubChem (CID 116722222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).