(3-ethyl-5-methylcyclopenten-1-yl)azanium

C8H16N+ — CID 58596377

IUPAC(3-ethyl-5-methylcyclopenten-1-yl)azanium
SMILESCCC1C=C([NH3+])C(C)C1
InChIInChI=1S/C8H15N/c1-3-7-4-6(2)8(9)5-7/h5-7H,3-4,9H2,1-2H3/p+1
InChIKeyDPODDEVMKCFTDY-UHFFFAOYSA-O
MW126.22 g/mol
LogP1.18
Rot. Bonds1

About (3-ethyl-5-methylcyclopenten-1-yl)azanium

(3-ethyl-5-methylcyclopenten-1-yl)azanium (PubChem CID 58596377) has the molecular formula C8H16N+ and a molecular weight of 126.22 g/mol. Its IUPAC name is (3-ethyl-5-methylcyclopenten-1-yl)azanium.

Molecular Properties

Compound Name(3-ethyl-5-methylcyclopenten-1-yl)azanium
PubChem CID58596377
Molecular FormulaC8H16N+
Molecular Weight126.22 g/mol
Exact Mass126.13
IUPAC Name(3-ethyl-5-methylcyclopenten-1-yl)azanium
SMILESCCC1C=C([NH3+])C(C)C1
InChIInChI=1S/C8H15N/c1-3-7-4-6(2)8(9)5-7/h5-7H,3-4,9H2,1-2H3/p+1
InChIKeyDPODDEVMKCFTDY-UHFFFAOYSA-O
XLogP1.18
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (3-ethyl-5-methylcyclopenten-1-yl)azanium?
The IUPAC name of (3-ethyl-5-methylcyclopenten-1-yl)azanium (CID 58596377) is (3-ethyl-5-methylcyclopenten-1-yl)azanium.
What is the SMILES notation for (3-ethyl-5-methylcyclopenten-1-yl)azanium?
The canonical SMILES for (3-ethyl-5-methylcyclopenten-1-yl)azanium is CCC1C=C([NH3+])C(C)C1.
What is the InChIKey of (3-ethyl-5-methylcyclopenten-1-yl)azanium?
The InChIKey is DPODDEVMKCFTDY-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H15N/c1-3-7-4-6(2)8(9)5-7/h5-7H,3-4,9H2,1-2H3/p+1.
What are the key properties of (3-ethyl-5-methylcyclopenten-1-yl)azanium?
(3-ethyl-5-methylcyclopenten-1-yl)azanium has a molecular weight of 126.22 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-5-methylcyclopenten-1-yl)azanium is sourced from PubChem (CID 58596377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).