2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine

C13H27N — CID 105013946

IUPAC2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine
SMILESCCC(CC)C(N)C1(CC)CCCC1
InChIInChI=1S/C13H27N/c1-4-11(5-2)12(14)13(6-3)9-7-8-10-13/h11-12H,4-10,14H2,1-3H3
InChIKeyBQBRVOZWZICCBQ-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.72
Rot. Bonds5

About 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine

2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine (PubChem CID 105013946) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine
PubChem CID105013946
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine
SMILESCCC(CC)C(N)C1(CC)CCCC1
InChIInChI=1S/C13H27N/c1-4-11(5-2)12(14)13(6-3)9-7-8-10-13/h11-12H,4-10,14H2,1-3H3
InChIKeyBQBRVOZWZICCBQ-UHFFFAOYSA-N
XLogP3.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(1-ethylcyclopentyl)-2-methylpropyl]hydrazine
CID 105281723
1-(1-ethylcyclopropyl)-2,2-dimethylpropan-1-amine
CID 130554169
1-(1-ethylcyclopentyl)-3-methylidenepentan-1-amine
CID 105006035
1-ethyl-1-(2-methylpentan-3-yl)cyclobutane
CID 170720683
(1-ethylcyclopentyl)-pyrimidin-5-ylmethanamine
CID 115827431
1-(1-ethylcyclohexyl)-N-methylethanamine
CID 142438459
1-(1-methylcyclopentyl)propan-1-amine
CID 114979259
1-but-3-en-2-yl-1-ethylcyclopentane;propane
CID 145053026
[1-(1-ethylcyclopentyl)-2-methylprop-2-enyl]hydrazine
CID 105320113
1-(1-ethylcyclopentyl)-2-(2,4,6-trimethylphenyl)ethanamine
CID 115829005
[(3,5-dimethylphenyl)-(1-ethylcyclopentyl)methyl]hydrazine
CID 105286762
[1-(1-ethylcyclopentyl)-2-methylpentyl]hydrazine
CID 107896028

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine?
The IUPAC name of 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine (CID 105013946) is 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine.
What is the SMILES notation for 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine?
The canonical SMILES for 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine is CCC(CC)C(N)C1(CC)CCCC1.
What is the InChIKey of 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine?
The InChIKey is BQBRVOZWZICCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-4-11(5-2)12(14)13(6-3)9-7-8-10-13/h11-12H,4-10,14H2,1-3H3.
What are the key properties of 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine?
2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine has a molecular weight of 197.37 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine is sourced from PubChem (CID 105013946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).