[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine

C19H24N2O2 — CID 118156697

IUPAC[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
SMILESCOc1cccc(Oc2cccc(N3CCCCC3)c2CN)c1
InChIInChI=1S/C19H24N2O2/c1-22-15-7-5-8-16(13-15)23-19-10-6-9-18(17(19)14-20)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12,14,20H2,1H3
InChIKeyRAJNGEMSBKXMFW-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.94
Rot. Bonds5

About [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine

[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine (PubChem CID 118156697) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine.

Molecular Properties

Compound Name[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
PubChem CID118156697
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
SMILESCOc1cccc(Oc2cccc(N3CCCCC3)c2CN)c1
InChIInChI=1S/C19H24N2O2/c1-22-15-7-5-8-16(13-15)23-19-10-6-9-18(17(19)14-20)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12,14,20H2,1H3
InChIKeyRAJNGEMSBKXMFW-UHFFFAOYSA-N
XLogP3.94
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
CID 118156701
[2-(azepan-1-yl)-6-[4-(trifluoromethoxy)phenoxy]phenyl]methanamine
CID 118156652
(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine
CID 118156691
[2-(azocan-1-yl)-6-chlorophenyl]methanamine
CID 28965332
1-(3-methoxy-2-prop-2-enylphenyl)piperidine
CID 101476464
1-(3-methoxyphenyl)azepane
CID 57276431
1-[(3-methoxyphenyl)methyl]piperidine;phenylmethanamine
CID 174819320
1-[3-[6-methoxy-2-(4-methoxyphenyl)naphthalen-1-yl]oxy-2-propylphenyl]piperidine;hydrochloride
CID 67602813
[2-(3,5-dimethoxyphenoxy)-6-fluorophenyl]methanamine
CID 79517647
[4-chloro-2-(3-methoxyphenoxy)phenyl]methanamine
CID 63082834
[2-(3,5-dimethylpiperidin-1-yl)-6-methoxyphenyl]methanamine
CID 134085949
1-methoxy-2-(3-methoxyphenoxy)benzene
CID 14020526

Frequently Asked Questions

What is the IUPAC name of [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
The IUPAC name of [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine (CID 118156697) is [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine.
What is the SMILES notation for [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
The canonical SMILES for [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine is COc1cccc(Oc2cccc(N3CCCCC3)c2CN)c1.
What is the InChIKey of [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
The InChIKey is RAJNGEMSBKXMFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-22-15-7-5-8-16(13-15)23-19-10-6-9-18(17(19)14-20)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12,14,20H2,1H3.
What are the key properties of [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine has a molecular weight of 312.41 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine is sourced from PubChem (CID 118156697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).