1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine

C16H34N2O — CID 79570643

IUPAC1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine
SMILESCCCNC(COCC)C1(N(CC)CC)CCCC1
InChIInChI=1S/C16H34N2O/c1-5-13-17-15(14-19-8-4)16(11-9-10-12-16)18(6-2)7-3/h15,17H,5-14H2,1-4H3
InChIKeyNPYKPJWCATZYJS-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.05
Rot. Bonds10

About 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine

1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine (PubChem CID 79570643) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine
PubChem CID79570643
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine
SMILESCCCNC(COCC)C1(N(CC)CC)CCCC1
InChIInChI=1S/C16H34N2O/c1-5-13-17-15(14-19-8-4)16(11-9-10-12-16)18(6-2)7-3/h15,17H,5-14H2,1-4H3
InChIKeyNPYKPJWCATZYJS-UHFFFAOYSA-N
XLogP3.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine
CID 79570079
1-[2-ethoxy-1-(propylamino)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79570214
N,N-diethyl-1-[1-(propylamino)pent-4-ynyl]cyclopentan-1-amine
CID 79070274
N,N-diethyl-1-[1-(propylamino)pent-3-ynyl]cyclopentan-1-amine
CID 79069965
N,N-diethyl-1-[2-methyl-1-(propylamino)propyl]cyclopentan-1-amine
CID 79069888
N,N-diethyl-1-[2-(furan-3-yl)-1-(propylamino)ethyl]cyclopentan-1-amine
CID 83178392
N,N-diethyl-1-[1-(ethylamino)-2-propan-2-yloxyethyl]cyclopentan-1-amine
CID 79569953
N,N-dimethyl-1-[2-propan-2-yloxy-1-(propylamino)ethyl]cycloheptan-1-amine
CID 79570086
1-[2-ethoxy-1-(methylamino)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79570777
N,N-diethyl-1-[1-(ethylamino)pentyl]cyclopentan-1-amine
CID 79070657
N,N-dimethyl-1-[3-methyl-1-(propylamino)butyl]cyclopentan-1-amine
CID 79069925
N,N,4-trimethyl-1-[2-propoxy-1-(propylamino)ethyl]cyclohexan-1-amine
CID 79569527

Frequently Asked Questions

What is the IUPAC name of 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
The IUPAC name of 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine (CID 79570643) is 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine.
What is the SMILES notation for 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
The canonical SMILES for 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine is CCCNC(COCC)C1(N(CC)CC)CCCC1.
What is the InChIKey of 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
The InChIKey is NPYKPJWCATZYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-5-13-17-15(14-19-8-4)16(11-9-10-12-16)18(6-2)7-3/h15,17H,5-14H2,1-4H3.
What are the key properties of 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine has a molecular weight of 270.46 g/mol, XLogP of 3.05, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-ethoxy-1-(propylamino)ethyl]-N,N-diethylcyclopentan-1-amine is sourced from PubChem (CID 79570643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).