1-(1-methylcyclopentyl)ethanamine

C8H17N — CID 115779370

IUPAC1-(1-methylcyclopentyl)ethanamine
SMILESCC(N)C1(C)CCCC1
InChIInChI=1S/C8H17N/c1-7(9)8(2)5-3-4-6-8/h7H,3-6,9H2,1-2H3
InChIKeyAQYVIQWTSBBRFM-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.91
Rot. Bonds1

About 1-(1-methylcyclopentyl)ethanamine

1-(1-methylcyclopentyl)ethanamine (PubChem CID 115779370) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is 1-(1-methylcyclopentyl)ethanamine.

Molecular Properties

Compound Name1-(1-methylcyclopentyl)ethanamine
PubChem CID115779370
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name1-(1-methylcyclopentyl)ethanamine
SMILESCC(N)C1(C)CCCC1
InChIInChI=1S/C8H17N/c1-7(9)8(2)5-3-4-6-8/h7H,3-6,9H2,1-2H3
InChIKeyAQYVIQWTSBBRFM-UHFFFAOYSA-N
XLogP1.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopentyl)ethanamine?
The IUPAC name of 1-(1-methylcyclopentyl)ethanamine (CID 115779370) is 1-(1-methylcyclopentyl)ethanamine.
What is the SMILES notation for 1-(1-methylcyclopentyl)ethanamine?
The canonical SMILES for 1-(1-methylcyclopentyl)ethanamine is CC(N)C1(C)CCCC1.
What is the InChIKey of 1-(1-methylcyclopentyl)ethanamine?
The InChIKey is AQYVIQWTSBBRFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-7(9)8(2)5-3-4-6-8/h7H,3-6,9H2,1-2H3.
What are the key properties of 1-(1-methylcyclopentyl)ethanamine?
1-(1-methylcyclopentyl)ethanamine has a molecular weight of 127.23 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopentyl)ethanamine is sourced from PubChem (CID 115779370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).