2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine

C11H17NOS — CID 65495835

IUPAC2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine
SMILESNCCC1(COCc2cccs2)CC1
InChIInChI=1S/C11H17NOS/c12-6-5-11(3-4-11)9-13-8-10-2-1-7-14-10/h1-2,7H,3-6,8-9,12H2
InChIKeyDDHSTRCIJAQOCX-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.39
Rot. Bonds6

About 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine

2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine (PubChem CID 65495835) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine
PubChem CID65495835
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine
SMILESNCCC1(COCc2cccs2)CC1
InChIInChI=1S/C11H17NOS/c12-6-5-11(3-4-11)9-13-8-10-2-1-7-14-10/h1-2,7H,3-6,8-9,12H2
InChIKeyDDHSTRCIJAQOCX-UHFFFAOYSA-N
XLogP2.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-(bromomethyl)cyclobutyl]methoxymethyl]thiophene
CID 65007480
2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanimidamide
CID 65494634
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-N-(thiophen-2-ylmethyl)cyclopropanamine
CID 65482513
thiophen-2-ylmethyl 1-(aminomethyl)cyclopropane-1-carboxylate
CID 115451050
[4,4-dimethyl-1-(thiophen-2-ylmethyl)cyclohexyl]methanamine
CID 65390783
2-(ethoxymethyl)thiophene
CID 12699283
2-[1-(2-thiophen-2-ylethoxymethyl)cyclopropyl]acetonitrile
CID 65494698
2-[1-(2-thiophen-2-ylethoxymethyl)cyclopropyl]acetic acid
CID 65497413
(2S)-2-(thiophen-2-ylmethoxymethyl)oxirane
CID 7127504
3-(thiophen-2-ylmethoxymethyl)pentan-3-amine
CID 64571428
2-(methoxymethyl)thiophene
CID 10240820
2-[2-(thiophen-2-ylmethoxy)ethyl]-1,3-dioxane
CID 66474968

Frequently Asked Questions

What is the IUPAC name of 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine?
The IUPAC name of 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine (CID 65495835) is 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine is NCCC1(COCc2cccs2)CC1.
What is the InChIKey of 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine?
The InChIKey is DDHSTRCIJAQOCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c12-6-5-11(3-4-11)9-13-8-10-2-1-7-14-10/h1-2,7H,3-6,8-9,12H2.
What are the key properties of 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine?
2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine has a molecular weight of 211.33 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine is sourced from PubChem (CID 65495835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).