1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine

C17H29NOS — CID 116762402

IUPAC1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
SMILESCCCNC(CCc1cccs1)C1(OCC)CCCC1
InChIInChI=1S/C17H29NOS/c1-3-13-18-16(10-9-15-8-7-14-20-15)17(19-4-2)11-5-6-12-17/h7-8,14,16,18H,3-6,9-13H2,1-2H3
InChIKeyPGSYMMCSEGGYFY-UHFFFAOYSA-N
MW295.49 g/mol
LogP4.40
Rot. Bonds9

About 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine

1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine (PubChem CID 116762402) has the molecular formula C17H29NOS and a molecular weight of 295.49 g/mol. Its IUPAC name is 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
PubChem CID116762402
Molecular FormulaC17H29NOS
Molecular Weight295.49 g/mol
Exact Mass295.20
IUPAC Name1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
SMILESCCCNC(CCc1cccs1)C1(OCC)CCCC1
InChIInChI=1S/C17H29NOS/c1-3-13-18-16(10-9-15-8-7-14-20-15)17(19-4-2)11-5-6-12-17/h7-8,14,16,18H,3-6,9-13H2,1-2H3
InChIKeyPGSYMMCSEGGYFY-UHFFFAOYSA-N
XLogP4.40
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.49
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(1-methoxycyclohexyl)-3-thiophen-2-ylpropan-1-amine
CID 116763172
1,1-dimethoxy-N-propyl-4-thiophen-2-ylbutan-2-amine
CID 79493483
[1-(1-ethoxy-3-methylcyclohexyl)-3-thiophen-2-ylpropyl]hydrazine
CID 105277692
1-(1-ethoxycycloheptyl)-2-thiophen-2-ylethanol
CID 116756164
1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine
CID 116762128
1-(1-ethoxycyclohexyl)-4-methyl-N-propylpent-4-en-1-amine
CID 114476070
N-ethyl-1-(1-methoxy-4-methylcyclohexyl)-3-thiophen-2-ylpropan-1-amine
CID 116766642
2-methyl-N-propyl-6-thiophen-2-ylhexan-3-amine
CID 63775526
1-(1-ethoxycyclohexyl)-N-propylhex-5-en-1-amine
CID 116764224
1-(1-ethoxycyclohexyl)-5,5,5-trifluoro-N-propylpentan-1-amine
CID 116764230
2-cyclopentyl-N-propyl-4-thiophen-2-ylbutan-1-amine
CID 112569967
1-cyclopropyl-1-methoxy-N-propyl-4-thiophen-2-ylbutan-2-amine
CID 116722695

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
The IUPAC name of 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine (CID 116762402) is 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine is CCCNC(CCc1cccs1)C1(OCC)CCCC1.
What is the InChIKey of 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
The InChIKey is PGSYMMCSEGGYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NOS/c1-3-13-18-16(10-9-15-8-7-14-20-15)17(19-4-2)11-5-6-12-17/h7-8,14,16,18H,3-6,9-13H2,1-2H3.
What are the key properties of 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine has a molecular weight of 295.49 g/mol, XLogP of 4.40, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxycyclopentyl)-N-propyl-3-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 116762402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).