1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine

C13H25N — CID 90963271

IUPAC1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine
SMILESCC(N)C1CCC(C2CCCC2)C1C
InChIInChI=1S/C13H25N/c1-9-12(10(2)14)7-8-13(9)11-5-3-4-6-11/h9-13H,3-8,14H2,1-2H3
InChIKeyLRGVHVAFCNWVSF-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.19
Rot. Bonds2

About 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine

1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine (PubChem CID 90963271) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine.

Molecular Properties

Compound Name1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine
PubChem CID90963271
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine
SMILESCC(N)C1CCC(C2CCCC2)C1C
InChIInChI=1S/C13H25N/c1-9-12(10(2)14)7-8-13(9)11-5-3-4-6-11/h9-13H,3-8,14H2,1-2H3
InChIKeyLRGVHVAFCNWVSF-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
The IUPAC name of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine (CID 90963271) is 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine.
What is the SMILES notation for 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
The canonical SMILES for 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine is CC(N)C1CCC(C2CCCC2)C1C.
What is the InChIKey of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
The InChIKey is LRGVHVAFCNWVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-9-12(10(2)14)7-8-13(9)11-5-3-4-6-11/h9-13H,3-8,14H2,1-2H3.
What are the key properties of 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine?
1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine has a molecular weight of 195.35 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentyl-2-methylcyclopentyl)ethanamine is sourced from PubChem (CID 90963271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).