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

C15H32N2O — CID 79570079

IUPAC1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine
SMILESCCNC(COCC)C1(N(CC)CC)CCCC1
InChIInChI=1S/C15H32N2O/c1-5-16-14(13-18-8-4)15(11-9-10-12-15)17(6-2)7-3/h14,16H,5-13H2,1-4H3
InChIKeyKMVCQCIEGDHOAE-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.66
Rot. Bonds9

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

1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine (PubChem CID 79570079) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine
PubChem CID79570079
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine
SMILESCCNC(COCC)C1(N(CC)CC)CCCC1
InChIInChI=1S/C15H32N2O/c1-5-16-14(13-18-8-4)15(11-9-10-12-15)17(6-2)7-3/h14,16H,5-13H2,1-4H3
InChIKeyKMVCQCIEGDHOAE-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
The IUPAC name of 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine (CID 79570079) is 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine.
What is the SMILES notation for 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
The canonical SMILES for 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine is CCNC(COCC)C1(N(CC)CC)CCCC1.
What is the InChIKey of 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
The InChIKey is KMVCQCIEGDHOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-16-14(13-18-8-4)15(11-9-10-12-15)17(6-2)7-3/h14,16H,5-13H2,1-4H3.
What are the key properties of 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine?
1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine has a molecular weight of 256.43 g/mol, XLogP of 2.66, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-ethoxy-1-(ethylamino)ethyl]-N,N-diethylcyclopentan-1-amine is sourced from PubChem (CID 79570079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).