1-(1-methoxycyclopentyl)prop-2-en-1-amine

C9H17NO — CID 104610553

IUPAC1-(1-methoxycyclopentyl)prop-2-en-1-amine
SMILESC=CC(N)C1(OC)CCCC1
InChIInChI=1S/C9H17NO/c1-3-8(10)9(11-2)6-4-5-7-9/h3,8H,1,4-7,10H2,2H3
InChIKeyYJSNUYDFQYGZKL-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.46
Rot. Bonds3

About 1-(1-methoxycyclopentyl)prop-2-en-1-amine

1-(1-methoxycyclopentyl)prop-2-en-1-amine (PubChem CID 104610553) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-(1-methoxycyclopentyl)prop-2-en-1-amine.

Molecular Properties

Compound Name1-(1-methoxycyclopentyl)prop-2-en-1-amine
PubChem CID104610553
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-(1-methoxycyclopentyl)prop-2-en-1-amine
SMILESC=CC(N)C1(OC)CCCC1
InChIInChI=1S/C9H17NO/c1-3-8(10)9(11-2)6-4-5-7-9/h3,8H,1,4-7,10H2,2H3
InChIKeyYJSNUYDFQYGZKL-UHFFFAOYSA-N
XLogP1.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.46
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

1-(1-methoxycyclohexyl)prop-2-en-1-amine
CID 116762563
1-(1-methoxycycloheptyl)-2-methylprop-2-en-1-amine
CID 116769785
1-(1-methoxycyclohexyl)prop-2-yn-1-amine
CID 116762592
1-(1-aminoprop-2-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79081473
N-ethyl-1-(1-methoxycyclobutyl)prop-2-en-1-amine
CID 116714475
2-cyclobutyl-1-(1-methoxycyclohexyl)ethanamine
CID 116762657
1-(1-methoxycyclopentyl)hex-5-en-1-ol
CID 104610355
1-(1-methoxycyclopentyl)hexan-1-amine
CID 104610613
(3,5-dimethylcyclohexyl)-(1-methoxycyclopentyl)methanamine
CID 104610627
1-(1-methoxycycloheptyl)hex-5-en-1-ol
CID 116756031
1-(1-methoxycycloheptyl)hexan-1-amine
CID 116769766
1-(1-methoxycyclopentyl)heptan-1-amine
CID 104610578

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclopentyl)prop-2-en-1-amine?
The IUPAC name of 1-(1-methoxycyclopentyl)prop-2-en-1-amine (CID 104610553) is 1-(1-methoxycyclopentyl)prop-2-en-1-amine.
What is the SMILES notation for 1-(1-methoxycyclopentyl)prop-2-en-1-amine?
The canonical SMILES for 1-(1-methoxycyclopentyl)prop-2-en-1-amine is C=CC(N)C1(OC)CCCC1.
What is the InChIKey of 1-(1-methoxycyclopentyl)prop-2-en-1-amine?
The InChIKey is YJSNUYDFQYGZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-8(10)9(11-2)6-4-5-7-9/h3,8H,1,4-7,10H2,2H3.
What are the key properties of 1-(1-methoxycyclopentyl)prop-2-en-1-amine?
1-(1-methoxycyclopentyl)prop-2-en-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclopentyl)prop-2-en-1-amine is sourced from PubChem (CID 104610553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).