N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine

C14H22N2O2 — CID 115005034

IUPACN-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine
SMILESCONCc1ccc(OC2CCN(C)CC2)cc1
InChIInChI=1S/C14H22N2O2/c1-16-9-7-14(8-10-16)18-13-5-3-12(4-6-13)11-15-17-2/h3-6,14-15H,7-11H2,1-2H3
InChIKeyWXXJHSIFVVGOAA-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.81
Rot. Bonds5

About N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine

N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine (PubChem CID 115005034) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine.

Molecular Properties

Compound NameN-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine
PubChem CID115005034
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine
SMILESCONCc1ccc(OC2CCN(C)CC2)cc1
InChIInChI=1S/C14H22N2O2/c1-16-9-7-14(8-10-16)18-13-5-3-12(4-6-13)11-15-17-2/h3-6,14-15H,7-11H2,1-2H3
InChIKeyWXXJHSIFVVGOAA-UHFFFAOYSA-N
XLogP1.81
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]methanesulfonamide
CID 99971373
[4-(1-methylpiperidin-4-yl)oxyphenyl]methanol
CID 84686879
1-(4-fluorophenyl)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]methanesulfonamide
CID 99971665
(2R)-2-(4-methoxyphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]butanamide
CID 99971607
4-(4-iodophenoxy)-1-methylpiperidine
CID 86710870
1-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]-3-phenylurea
CID 50875367
N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 154741235
2-(2-methoxyphenoxy)-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]acetamide
CID 99970858
[4-(1-methylpyrrolidin-3-yl)oxyphenyl]methanamine
CID 117052585
3-cyano-3-methyl-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]butanamide
CID 122140123
3-[4-(1-methylazepan-4-yl)oxyphenyl]propan-1-amine
CID 117095267
4-(1-methylpiperidin-4-yl)oxypyridine
CID 18723159

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine?
The IUPAC name of N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine (CID 115005034) is N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine.
What is the SMILES notation for N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine?
The canonical SMILES for N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine is CONCc1ccc(OC2CCN(C)CC2)cc1.
What is the InChIKey of N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine?
The InChIKey is WXXJHSIFVVGOAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-16-9-7-14(8-10-16)18-13-5-3-12(4-6-13)11-15-17-2/h3-6,14-15H,7-11H2,1-2H3.
What are the key properties of N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine?
N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine has a molecular weight of 250.34 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine is sourced from PubChem (CID 115005034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).