1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine

C14H22N2O — CID 54965277

IUPAC1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine
SMILESCNC1CCN(c2cccc(COC)c2)CC1
InChIInChI=1S/C14H22N2O/c1-15-13-6-8-16(9-7-13)14-5-3-4-12(10-14)11-17-2/h3-5,10,13,15H,6-9,11H2,1-2H3
InChIKeyNIVHYIBOENDPQF-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.02
Rot. Bonds4

About 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine

1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine (PubChem CID 54965277) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine
PubChem CID54965277
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine
SMILESCNC1CCN(c2cccc(COC)c2)CC1
InChIInChI=1S/C14H22N2O/c1-15-13-6-8-16(9-7-13)14-5-3-4-12(10-14)11-17-2/h3-5,10,13,15H,6-9,11H2,1-2H3
InChIKeyNIVHYIBOENDPQF-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethylphenyl)-N-methylpiperidin-4-amine
CID 43315435
N-[[1-[3-(methoxymethyl)phenyl]pyrrolidin-3-yl]methyl]propan-2-amine
CID 62512611
N-ethyl-1-[4-(methoxymethyl)phenyl]piperidin-4-amine
CID 114253160
1-cyclopropyl-3-[1-(3-ethylphenyl)piperidin-4-yl]thiourea
CID 48926076
1-[[3-(methoxymethyl)phenyl]methyl]-2-methyl-3-(1-phenylpyrrolidin-3-yl)guanidine;hydroiodide
CID 111910966
N-[1-[3-(aminomethyl)phenyl]piperidin-4-yl]acetamide
CID 102814279
N-[3-(methoxymethyl)phenyl]-1-methylazepan-4-amine
CID 65070554
N-[3-(methoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103931159
1-(3-bromo-4-methylphenyl)-N-methylpiperidin-4-amine
CID 63334285
9-[3-(methoxymethyl)phenyl]-9-azabicyclo[3.3.1]nonan-3-one
CID 62714126
1-phenyl-N-phenylmethoxypiperidin-4-amine
CID 106820391
1-[3-(methoxymethyl)phenyl]pyrrolidin-2-one
CID 58826741

Frequently Asked Questions

What is the IUPAC name of 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine?
The IUPAC name of 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine (CID 54965277) is 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine?
The canonical SMILES for 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine is CNC1CCN(c2cccc(COC)c2)CC1.
What is the InChIKey of 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine?
The InChIKey is NIVHYIBOENDPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-15-13-6-8-16(9-7-13)14-5-3-4-12(10-14)11-17-2/h3-5,10,13,15H,6-9,11H2,1-2H3.
What are the key properties of 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine?
1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine has a molecular weight of 234.34 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine is sourced from PubChem (CID 54965277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).