1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine

C13H19NO — CID 64516240

IUPAC1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine
SMILESCOc1ccccc1C1(N)CCC(C)C1
InChIInChI=1S/C13H19NO/c1-10-7-8-13(14,9-10)11-5-3-4-6-12(11)15-2/h3-6,10H,7-9,14H2,1-2H3
InChIKeyCUYIJXCPQBTEDT-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.67
Rot. Bonds2

About 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine

1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine (PubChem CID 64516240) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine
PubChem CID64516240
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine
SMILESCOc1ccccc1C1(N)CCC(C)C1
InChIInChI=1S/C13H19NO/c1-10-7-8-13(14,9-10)11-5-3-4-6-12(11)15-2/h3-6,10H,7-9,14H2,1-2H3
InChIKeyCUYIJXCPQBTEDT-UHFFFAOYSA-N
XLogP2.67
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine?
The IUPAC name of 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine (CID 64516240) is 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine is COc1ccccc1C1(N)CCC(C)C1.
What is the InChIKey of 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine?
The InChIKey is CUYIJXCPQBTEDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-7-8-13(14,9-10)11-5-3-4-6-12(11)15-2/h3-6,10H,7-9,14H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine?
1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-methylcyclopentan-1-amine is sourced from PubChem (CID 64516240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).