1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine

C14H23NOS — CID 106200095

IUPAC1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine
SMILESCCC(N)C(OCCC1CCC1)c1cccs1
InChIInChI=1S/C14H23NOS/c1-2-12(15)14(13-7-4-10-17-13)16-9-8-11-5-3-6-11/h4,7,10-12,14H,2-3,5-6,8-9,15H2,1H3
InChIKeyMOFIXTLVDCCXOS-UHFFFAOYSA-N
MW253.41 g/mol
LogP3.73
Rot. Bonds7

About 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine

1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine (PubChem CID 106200095) has the molecular formula C14H23NOS and a molecular weight of 253.41 g/mol. Its IUPAC name is 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine.

Molecular Properties

Compound Name1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine
PubChem CID106200095
Molecular FormulaC14H23NOS
Molecular Weight253.41 g/mol
Exact Mass253.15
IUPAC Name1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine
SMILESCCC(N)C(OCCC1CCC1)c1cccs1
InChIInChI=1S/C14H23NOS/c1-2-12(15)14(13-7-4-10-17-13)16-9-8-11-5-3-6-11/h4,7,10-12,14H,2-3,5-6,8-9,15H2,1H3
InChIKeyMOFIXTLVDCCXOS-UHFFFAOYSA-N
XLogP3.73
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-cyclobutylethoxy)-1-(4-methylphenyl)butan-2-amine
CID 106200131
1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine
CID 106200053
1-hexoxy-1-thiophen-2-ylbutan-2-amine
CID 55021024
1-(oxolan-3-ylmethoxy)-1-thiophen-2-ylbutan-2-amine
CID 55021106
1-(2-pyridin-2-ylethoxy)-1-thiophen-2-ylbutan-2-amine
CID 55021086
1-[(4-chlorophenyl)methoxy]-1-thiophen-2-ylbutan-2-amine
CID 65124390
2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine
CID 106201059
1-[(3-bromophenyl)methoxy]-1-thiophen-2-ylbutan-2-amine
CID 82827669
1-(2-bromophenyl)-1-(2-cyclobutylethoxy)propan-2-amine
CID 106200055
1-(cyclopentylmethoxy)-1-(3-methylthiophen-2-yl)butan-2-amine
CID 66322795
1-(2-cyclobutylethoxy)-1-pyridin-2-ylpropan-2-amine
CID 106200221
1-(4-ethylpiperidin-1-yl)-1-thiophen-2-ylbutan-2-amine
CID 55021620

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine?
The IUPAC name of 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine (CID 106200095) is 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine.
What is the SMILES notation for 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine?
The canonical SMILES for 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine is CCC(N)C(OCCC1CCC1)c1cccs1.
What is the InChIKey of 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine?
The InChIKey is MOFIXTLVDCCXOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NOS/c1-2-12(15)14(13-7-4-10-17-13)16-9-8-11-5-3-6-11/h4,7,10-12,14H,2-3,5-6,8-9,15H2,1H3.
What are the key properties of 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine?
1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine has a molecular weight of 253.41 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine is sourced from PubChem (CID 106200095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).