2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine

C16H25NO2 — CID 62086587

IUPAC2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine
SMILESCCC(NC1CCCC1OC)c1ccccc1OC
InChIInChI=1S/C16H25NO2/c1-4-13(12-8-5-6-10-15(12)18-2)17-14-9-7-11-16(14)19-3/h5-6,8,10,13-14,16-17H,4,7,9,11H2,1-3H3
InChIKeyHHCGCAQJDXRJNB-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.30
Rot. Bonds6

About 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine

2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine (PubChem CID 62086587) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine
PubChem CID62086587
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine
SMILESCCC(NC1CCCC1OC)c1ccccc1OC
InChIInChI=1S/C16H25NO2/c1-4-13(12-8-5-6-10-15(12)18-2)17-14-9-7-11-16(14)19-3/h5-6,8,10,13-14,16-17H,4,7,9,11H2,1-3H3
InChIKeyHHCGCAQJDXRJNB-UHFFFAOYSA-N
XLogP3.30
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine?
The IUPAC name of 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine (CID 62086587) is 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine.
What is the SMILES notation for 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine?
The canonical SMILES for 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine is CCC(NC1CCCC1OC)c1ccccc1OC.
What is the InChIKey of 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine?
The InChIKey is HHCGCAQJDXRJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-13(12-8-5-6-10-15(12)18-2)17-14-9-7-11-16(14)19-3/h5-6,8,10,13-14,16-17H,4,7,9,11H2,1-3H3.
What are the key properties of 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine?
2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine is sourced from PubChem (CID 62086587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).