1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine

C15H24N2O2 — CID 28802855

IUPAC1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine
SMILESCOc1cccc(OCCCN2CCC(N)CC2)c1
InChIInChI=1S/C15H24N2O2/c1-18-14-4-2-5-15(12-14)19-11-3-8-17-9-6-13(16)7-10-17/h2,4-5,12-13H,3,6-11,16H2,1H3
InChIKeyWPCMIKHWPGKGOP-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.89
Rot. Bonds6

About 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine

1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine (PubChem CID 28802855) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine
PubChem CID28802855
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine
SMILESCOc1cccc(OCCCN2CCC(N)CC2)c1
InChIInChI=1S/C15H24N2O2/c1-18-14-4-2-5-15(12-14)19-11-3-8-17-9-6-13(16)7-10-17/h2,4-5,12-13H,3,6-11,16H2,1H3
InChIKeyWPCMIKHWPGKGOP-UHFFFAOYSA-N
XLogP1.89
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[6-(3-methoxyphenoxy)hexyl]-4-methylpiperidine
CID 11836207
1-[6-(3-methoxyphenoxy)hexyl]piperidine
CID 2232457
1-[3-(3-methoxyphenoxy)propyl]-4-phenylpiperazine
CID 3050368
1-[3-(3-methoxyphenoxy)propyl]azepane;oxalic acid
CID 2944095
1-[3-(3-methylphenoxy)propyl]piperidin-4-ol
CID 39352208
1-[2-(3-methoxyphenyl)ethyl]pyrrolidin-3-amine
CID 82158725
3-[1-[3-(6-methoxynaphthalen-2-yl)oxypropyl]piperidin-4-yl]pyridine
CID 21198085
4-[3-(4-aminopiperidin-1-yl)propoxy]benzoic acid
CID 129300145
(3R)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-amine
CID 24904638
2-(4-aminopiperidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 56828695
1-(3-methoxypropyl)piperidin-4-amine;hydrochloride
CID 141311767
1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine
CID 43556436

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine?
The IUPAC name of 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine (CID 28802855) is 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine.
What is the SMILES notation for 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine?
The canonical SMILES for 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine is COc1cccc(OCCCN2CCC(N)CC2)c1.
What is the InChIKey of 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine?
The InChIKey is WPCMIKHWPGKGOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-18-14-4-2-5-15(12-14)19-11-3-8-17-9-6-13(16)7-10-17/h2,4-5,12-13H,3,6-11,16H2,1H3.
What are the key properties of 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine?
1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine is sourced from PubChem (CID 28802855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).