1-(1-methoxycyclopentyl)pent-4-en-1-amine

C11H21NO — CID 104610591

IUPAC1-(1-methoxycyclopentyl)pent-4-en-1-amine
SMILESC=CCCC(N)C1(OC)CCCC1
InChIInChI=1S/C11H21NO/c1-3-4-7-10(12)11(13-2)8-5-6-9-11/h3,10H,1,4-9,12H2,2H3
InChIKeyCZAYKXLEIQVGEG-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.24
Rot. Bonds5

About 1-(1-methoxycyclopentyl)pent-4-en-1-amine

1-(1-methoxycyclopentyl)pent-4-en-1-amine (PubChem CID 104610591) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-(1-methoxycyclopentyl)pent-4-en-1-amine.

Molecular Properties

Compound Name1-(1-methoxycyclopentyl)pent-4-en-1-amine
PubChem CID104610591
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-(1-methoxycyclopentyl)pent-4-en-1-amine
SMILESC=CCCC(N)C1(OC)CCCC1
InChIInChI=1S/C11H21NO/c1-3-4-7-10(12)11(13-2)8-5-6-9-11/h3,10H,1,4-9,12H2,2H3
InChIKeyCZAYKXLEIQVGEG-UHFFFAOYSA-N
XLogP2.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclopentyl)pent-4-en-1-amine?
The IUPAC name of 1-(1-methoxycyclopentyl)pent-4-en-1-amine (CID 104610591) is 1-(1-methoxycyclopentyl)pent-4-en-1-amine.
What is the SMILES notation for 1-(1-methoxycyclopentyl)pent-4-en-1-amine?
The canonical SMILES for 1-(1-methoxycyclopentyl)pent-4-en-1-amine is C=CCCC(N)C1(OC)CCCC1.
What is the InChIKey of 1-(1-methoxycyclopentyl)pent-4-en-1-amine?
The InChIKey is CZAYKXLEIQVGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-4-7-10(12)11(13-2)8-5-6-9-11/h3,10H,1,4-9,12H2,2H3.
What are the key properties of 1-(1-methoxycyclopentyl)pent-4-en-1-amine?
1-(1-methoxycyclopentyl)pent-4-en-1-amine has a molecular weight of 183.29 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclopentyl)pent-4-en-1-amine is sourced from PubChem (CID 104610591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).