1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine

C14H22N2O — CID 54975421

IUPAC1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine
SMILESCNC1CCN(c2ccc(OC)cc2)C(C)C1
InChIInChI=1S/C14H22N2O/c1-11-10-12(15-2)8-9-16(11)13-4-6-14(17-3)7-5-13/h4-7,11-12,15H,8-10H2,1-3H3
InChIKeyXRTSPUFUFMXTKW-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.27
Rot. Bonds3

About 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine

1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine (PubChem CID 54975421) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine
PubChem CID54975421
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine
SMILESCNC1CCN(c2ccc(OC)cc2)C(C)C1
InChIInChI=1S/C14H22N2O/c1-11-10-12(15-2)8-9-16(11)13-4-6-14(17-3)7-5-13/h4-7,11-12,15H,8-10H2,1-3H3
InChIKeyXRTSPUFUFMXTKW-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

1-(3-methoxyphenyl)-N,2-dimethylpiperidin-4-amine
CID 54975485
1-(4-ethylphenyl)-N,2-dimethylpiperidin-4-amine
CID 54975874
1-(3-butan-2-yloxyphenyl)-N,2-dimethylpiperidin-4-amine
CID 62327025
(2S,5R)-1-(4-methoxyphenyl)-2,5-dimethylpiperazine
CID 95443898
N-[1-(4-methoxyphenyl)ethyl]-1,2-dimethylpiperidin-4-amine
CID 81333341
4-(4-iodophenyl)sulfonyl-1-(4-methoxyphenyl)-2-methylpiperazine
CID 5167462
1-[2-fluoro-5-(trifluoromethyl)phenyl]-N,2-dimethylpiperidin-4-amine
CID 63036677
1-(4-methoxyphenyl)-2-methyl-4-pentan-3-ylpiperazine
CID 20735315
methyl (2S)-1-(4-methoxyphenyl)pyrrolidine-2-carboxylate
CID 96706526
2-(4-methoxyphenyl)-1-phenylpyrrolidine-3-carboxylic acid
CID 53435681
1-(3,4-dimethoxyphenyl)-2-methylpiperidin-4-amine
CID 54975867
N-(4-methoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
CID 81466424

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine?
The IUPAC name of 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine (CID 54975421) is 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine is CNC1CCN(c2ccc(OC)cc2)C(C)C1.
What is the InChIKey of 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine?
The InChIKey is XRTSPUFUFMXTKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-10-12(15-2)8-9-16(11)13-4-6-14(17-3)7-5-13/h4-7,11-12,15H,8-10H2,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine?
1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine has a molecular weight of 234.34 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 54975421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).