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5-(1-Methylpiperidin-4-yloxy)biphenyl-2-ylamine

HCID 68705243
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
877125-79-6
Standard SMILES
CN1CCC(Oc2ccc(N)c(-c3ccccc3)c2)CC1
InChIKey
LGRZCFIEOSKGMV-UHFFFAOYSA-N
Molecular formula
C18H22N2O
Average molar mass
282.4 g/mol
Monoisotopic mass
282.17321333

Names & identifiers

Preferred name
5-(1-Methylpiperidin-4-yloxy)biphenyl-2-ylamine
IUPAC
4-(1-methylpiperidin-4-yl)oxy-2-phenylaniline

Names & synonyms

5-(1-methylpiperidin-4-yloxy)biphenyl-2-ylamine877125-79-65-((1-Methylpiperidin-4-yl)oxy)-[1,1'-biphenyl]-2-amineSCHEMBL3591452LGRZCFIEOSKGMV-UHFFFAOYSA-NDTXSID501209464DB-332496A1-818595-[(1-Methylpiperidin-4-yl)oxy][1,1'-biphenyl]-2-amine5-[(1-Methyl-4-piperidinyl)oxy][1,1a(2)-biphenyl]-2-amine

Database identifiers

CAS
877125-79-6
PubChem CID
68705243
DTXSID
DTXSID501209464

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
38.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
308

Related reactions

4 records
New reaction record
HRID 96489 reaction equation
HRID 96489As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 645498 reaction equation
HRID 645498As reactantuspto-grants-2010_04
HRID 645501 reaction equation
HRID 645501As productuspto-grants-2010_04
HRID 1136155 reaction equation
HRID 1136155As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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