5-methoxycyclopent-2-en-1-amine

C6H11NO — CID 123826273

IUPAC5-methoxycyclopent-2-en-1-amine
SMILESCOC1CC=CC1N
InChIInChI=1S/C6H11NO/c1-8-6-4-2-3-5(6)7/h2-3,5-6H,4,7H2,1H3
InChIKeyKXQYWSWHTQVTMF-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.29
Rot. Bonds1

About 5-methoxycyclopent-2-en-1-amine

5-methoxycyclopent-2-en-1-amine (PubChem CID 123826273) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 5-methoxycyclopent-2-en-1-amine.

Molecular Properties

Compound Name5-methoxycyclopent-2-en-1-amine
PubChem CID123826273
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name5-methoxycyclopent-2-en-1-amine
SMILESCOC1CC=CC1N
InChIInChI=1S/C6H11NO/c1-8-6-4-2-3-5(6)7/h2-3,5-6H,4,7H2,1H3
InChIKeyKXQYWSWHTQVTMF-UHFFFAOYSA-N
XLogP0.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Aminocyclopent-3-en-1-ol
CID 12943941
trans-4-Hydroxy-3-amino-cyclopentene
CID 12943943
(1S,2S)-2-aminocyclopent-3-en-1-ol
CID 54055426
1-(2,3-Dihydrofuran-2-yl)ethanamine
CID 68390758
6-Methoxycyclohex-2-en-1-amine
CID 76223862
1-(2,3-Dihydrofuran-2-yl)prop-2-en-1-amine
CID 89058363
1-(5-Methyl-2,3-dihydrofuran-2-yl)ethanamine
CID 89098997
(1R,5R)-5-(2-methoxypropan-2-yloxy)cyclopent-2-en-1-amine
CID 138701459
N,N,1,4,5,5,6-heptadeuterio-6-methoxycyclohex-2-en-1-amine
CID 141756165
2-Methyl-2,3-dihydrofuran-3-amine
CID 147439642
6-Methoxycyclohex-3-en-1-amine
CID 163743001
5-Methoxy-2-methylcyclopent-2-en-1-amine
CID 169841950

Frequently Asked Questions

What is the IUPAC name of 5-methoxycyclopent-2-en-1-amine?
The IUPAC name of 5-methoxycyclopent-2-en-1-amine (CID 123826273) is 5-methoxycyclopent-2-en-1-amine.
What is the SMILES notation for 5-methoxycyclopent-2-en-1-amine?
The canonical SMILES for 5-methoxycyclopent-2-en-1-amine is COC1CC=CC1N.
What is the InChIKey of 5-methoxycyclopent-2-en-1-amine?
The InChIKey is KXQYWSWHTQVTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-8-6-4-2-3-5(6)7/h2-3,5-6H,4,7H2,1H3.
What are the key properties of 5-methoxycyclopent-2-en-1-amine?
5-methoxycyclopent-2-en-1-amine has a molecular weight of 113.16 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxycyclopent-2-en-1-amine is sourced from PubChem (CID 123826273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).