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

C19H24N2O2 — CID 118156701

IUPAC[2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
SMILESCOc1ccccc1Oc1cccc(N2CCCCC2)c1CN
InChIInChI=1S/C19H24N2O2/c1-22-18-9-3-4-10-19(18)23-17-11-7-8-16(15(17)14-20)21-12-5-2-6-13-21/h3-4,7-11H,2,5-6,12-14,20H2,1H3
InChIKeyBTVVPDNSANUMCS-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.94
Rot. Bonds5

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

[2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine (PubChem CID 118156701) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine.

Molecular Properties

Compound Name[2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
PubChem CID118156701
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name[2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
SMILESCOc1ccccc1Oc1cccc(N2CCCCC2)c1CN
InChIInChI=1S/C19H24N2O2/c1-22-18-9-3-4-10-19(18)23-17-11-7-8-16(15(17)14-20)21-12-5-2-6-13-21/h3-4,7-11H,2,5-6,12-14,20H2,1H3
InChIKeyBTVVPDNSANUMCS-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

1-{3-[(3-Chlorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263305
1-(3-(Benzyloxy)-2-methylphenyl)piperazine
CID 25263303
1-(2-(Phenoxymethyl)phenyl)piperazine
CID 45483466
1-{3-[(3-Fluorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263304
3-[2-Methyl-3-(piperazin-1-yl)phenoxymethyl]benzonitrile
CID 25263306
1-{3-[(2-Fluorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263307
1-{3-[(3,4-Difluorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263308
1-{2-methyl-3-[(1S)-1-phenylethoxy]phenyl}piperazine
CID 25263311
1-{2-methyl-3-[(1R)-1-phenylethoxy]phenyl}piperazine
CID 25263312
1-(2,3-Dihydro-benzo[1,4]dioxin-5-yl)-4-(4-phenyl-butyl)-piperazine; hydrochloride
CID 10405775
(2,3-Dimethoxybenzyl)[4-(1-piperidinyl)phenyl]amine
CID 834331
1-(1,4 Benzodioxan-6-yl)-4-(4-fluorobenzyl)piperazine
CID 9797495

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
The IUPAC name of [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine (CID 118156701) is [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine.
What is the SMILES notation for [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
The canonical SMILES for [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine is COc1ccccc1Oc1cccc(N2CCCCC2)c1CN.
What is the InChIKey of [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
The InChIKey is BTVVPDNSANUMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-22-18-9-3-4-10-19(18)23-17-11-7-8-16(15(17)14-20)21-12-5-2-6-13-21/h3-4,7-11H,2,5-6,12-14,20H2,1H3.
What are the key properties of [2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine?
[2-(2-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-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine is sourced from PubChem (CID 118156701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).