2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine

C12H19NOS — CID 66321305

IUPAC2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine
SMILESNCC(OCC1CCCC1)c1ccsc1
InChIInChI=1S/C12H19NOS/c13-7-12(11-5-6-15-9-11)14-8-10-3-1-2-4-10/h5-6,9-10,12H,1-4,7-8,13H2
InChIKeyKZULPXKKFNVCPJ-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.95
Rot. Bonds5

About 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine

2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine (PubChem CID 66321305) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine
PubChem CID66321305
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine
SMILESNCC(OCC1CCCC1)c1ccsc1
InChIInChI=1S/C12H19NOS/c13-7-12(11-5-6-15-9-11)14-8-10-3-1-2-4-10/h5-6,9-10,12H,1-4,7-8,13H2
InChIKeyKZULPXKKFNVCPJ-UHFFFAOYSA-N
XLogP2.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(7s)-4h,5h,7h-Thieno[2,3-c]pyran-7-yl]methanamine
CID 89532776
4,5,6,8-Tetrahydrothieno[2,3-c]oxepin-8-ylmethanamine
CID 166627175
4H,6H,7H-thieno[3,2-c]pyran-4-ylmethanamine
CID 12225896
[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]methanamine
CID 42556025
2-Thiophen-3-yl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 61623420
1-Thiophen-3-yl-1-(2,2,2-trifluoroethoxy)propan-2-amine
CID 61623421
1-Thiophen-3-yl-1-(2,2,2-trifluoroethoxy)butan-2-amine
CID 61623469
2-(3-Methylthiophen-2-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 61626659
1-(3-Methylthiophen-2-yl)-1-(1,1,1-trifluoropropan-2-yloxy)propan-2-amine
CID 66274543
1-Thiophen-3-yl-1-(1,1,1-trifluoropropan-2-yloxy)butan-2-amine
CID 66274986
2-Thiophen-3-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66276059
1-Thiophen-3-yl-1-(1,1,1-trifluoropropan-2-yloxy)propan-2-amine
CID 66276938

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine?
The IUPAC name of 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine (CID 66321305) is 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine.
What is the SMILES notation for 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine?
The canonical SMILES for 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine is NCC(OCC1CCCC1)c1ccsc1.
What is the InChIKey of 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine?
The InChIKey is KZULPXKKFNVCPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c13-7-12(11-5-6-15-9-11)14-8-10-3-1-2-4-10/h5-6,9-10,12H,1-4,7-8,13H2.
What are the key properties of 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine?
2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine has a molecular weight of 225.36 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethoxy)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 66321305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).