N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine

C15H28N2O — CID 79066104

IUPACN-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine
SMILESC=CCC(NCC)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C15H28N2O/c1-3-7-14(16-4-2)15(8-5-6-9-15)17-10-12-18-13-11-17/h3,14,16H,1,4-13H2,2H3
InChIKeyIUJUFHNWSSBOOP-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.19
Rot. Bonds6

About N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine

N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine (PubChem CID 79066104) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine
PubChem CID79066104
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine
SMILESC=CCC(NCC)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C15H28N2O/c1-3-7-14(16-4-2)15(8-5-6-9-15)17-10-12-18-13-11-17/h3,14,16H,1,4-13H2,2H3
InChIKeyIUJUFHNWSSBOOP-UHFFFAOYSA-N
XLogP2.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-ol
CID 79060228
N-ethyl-1-(1-morpholin-4-ylcyclopentyl)-2-thiophen-2-ylethanamine
CID 79060861
N-[2-cyclobutyl-1-(1-morpholin-4-ylcyclopentyl)ethyl]propan-1-amine
CID 79062246
1-[1-(ethylamino)but-3-enyl]-N,N-dimethylcycloheptan-1-amine
CID 79081392
1-(1-morpholin-4-ylcyclopentyl)hexylhydrazine
CID 105243126
1-(1-morpholin-4-ylcyclopentyl)propan-1-ol
CID 79060024
(2R)-1-[1-(1-morpholin-4-ylcyclopentyl)ethylamino]butan-2-ol
CID 86801048
N-ethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pent-4-yn-1-amine
CID 79057451
N-ethyl-1-(1-pyrrolidin-1-ylcyclopentyl)octan-1-amine
CID 79059978
1-(1-morpholin-4-ylcyclopentyl)ethanamine;dihydrochloride
CID 54595571
N-ethyl-1-(1-piperidin-1-ylcyclopentyl)-2-propoxyethanamine
CID 79569195
[5-methoxy-1-(1-morpholin-4-ylcyclopentyl)pentyl]hydrazine
CID 112754341

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine?
The IUPAC name of N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine (CID 79066104) is N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine.
What is the SMILES notation for N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine?
The canonical SMILES for N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine is C=CCC(NCC)C1(N2CCOCC2)CCCC1.
What is the InChIKey of N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine?
The InChIKey is IUJUFHNWSSBOOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-7-14(16-4-2)15(8-5-6-9-15)17-10-12-18-13-11-17/h3,14,16H,1,4-13H2,2H3.
What are the key properties of N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine?
N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine has a molecular weight of 252.40 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-morpholin-4-ylcyclopentyl)but-3-en-1-amine is sourced from PubChem (CID 79066104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).