1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine

C14H22N2O — CID 55129581

IUPAC1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine
SMILESCNC1CCN(c2ccc(OC)cc2C)CC1
InChIInChI=1S/C14H22N2O/c1-11-10-13(17-3)4-5-14(11)16-8-6-12(15-2)7-9-16/h4-5,10,12,15H,6-9H2,1-3H3
InChIKeyLDUOEDRAEREMPM-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.19
Rot. Bonds3

About 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine

1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine (PubChem CID 55129581) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine
PubChem CID55129581
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine
SMILESCNC1CCN(c2ccc(OC)cc2C)CC1
InChIInChI=1S/C14H22N2O/c1-11-10-13(17-3)4-5-14(11)16-8-6-12(15-2)7-9-16/h4-5,10,12,15H,6-9H2,1-3H3
InChIKeyLDUOEDRAEREMPM-UHFFFAOYSA-N
XLogP2.19
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 ≤ 52.19
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-(2,5-dimethoxyphenyl)-N-methylpiperidin-4-amine
CID 43315071
1-(4-methoxy-2-methylphenyl)-4-methylpiperazine
CID 21363831
2-(4-methoxy-2-methylphenyl)-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 79939793
1-(3-fluoro-5-methoxyphenyl)-N-methylpiperidin-4-amine
CID 114263163
2-(4-methoxy-2-methylphenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929436
6-methoxy-2-(4-methoxy-2-methylphenyl)-3,4-dihydro-1H-isoquinoline
CID 69472084
1-(4-methoxy-2-methylphenyl)-3-phenylpiperazine
CID 64952389
6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
CID 83833453
1-(4-methoxy-2-methylphenyl)-3-(2-methylpropyl)piperazine
CID 64952586
(3S)-1-(6-methoxyquinolin-4-yl)-N-methylpyrrolidin-3-amine
CID 66954288
1-[4-(3-methoxypropoxy)-2-methylphenyl]piperidin-4-amine
CID 83134817
1-(2,4-dibromo-5-methoxyphenyl)-N-methylpiperidin-4-amine
CID 103414445

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine?
The IUPAC name of 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine (CID 55129581) is 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine?
The canonical SMILES for 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine is CNC1CCN(c2ccc(OC)cc2C)CC1.
What is the InChIKey of 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine?
The InChIKey is LDUOEDRAEREMPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-10-13(17-3)4-5-14(11)16-8-6-12(15-2)7-9-16/h4-5,10,12,15H,6-9H2,1-3H3.
What are the key properties of 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine?
1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine has a molecular weight of 234.34 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine is sourced from PubChem (CID 55129581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).