1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride

C12H19ClN2O — CID 57363410

IUPAC1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride
SMILESCOc1ccc(N2CCC(N)CC2)cc1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-15-12-4-2-11(3-5-12)14-8-6-10(13)7-9-14;/h2-5,10H,6-9,13H2,1H3;1H
InChIKeySLVNOLKZYLOBAU-UHFFFAOYSA-N
MW242.75 g/mol
LogP2.04
Rot. Bonds2

About 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride

1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride (PubChem CID 57363410) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride.

Molecular Properties

Compound Name1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride
PubChem CID57363410
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride
SMILESCOc1ccc(N2CCC(N)CC2)cc1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-15-12-4-2-11(3-5-12)14-8-6-10(13)7-9-14;/h2-5,10H,6-9,13H2,1H3;1H
InChIKeySLVNOLKZYLOBAU-UHFFFAOYSA-N
XLogP2.04
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 52.04
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-[1-(4-methoxyphenyl)piperidin-4-yl]ethanamine
CID 139509898
1-(4-methoxyphenyl)-3,3-dimethylpiperidin-4-amine
CID 117024391
1-[1-(4-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]piperidin-4-amine
CID 117124712
1-(4-fluorophenyl)piperidin-4-amine;hydrochloride
CID 53442031
1-(4-methoxyphenyl)piperidine
CID 10130315
1-(4-cycloheptyloxyphenyl)piperidin-4-amine
CID 82925702
1-(4-methoxyphenyl)-4-piperidin-4-ylpiperazine;dihydrochloride
CID 175654296
5-[1-(4-methoxyphenyl)piperidin-4-yl]pyrimidine-2,4-diamine
CID 21290634
ethane;ethene;1-(4-methoxyphenyl)piperidine
CID 144518047
1-(4-ethylphenyl)-4-(4-methoxyphenyl)piperidine
CID 166657002
(3R)-1-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid
CID 28875717
1-(4-ethoxyphenyl)pyrrolidin-3-amine
CID 43314939

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride?
The IUPAC name of 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride (CID 57363410) is 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride.
What is the SMILES notation for 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride?
The canonical SMILES for 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride is COc1ccc(N2CCC(N)CC2)cc1.Cl.
What is the InChIKey of 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride?
The InChIKey is SLVNOLKZYLOBAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c1-15-12-4-2-11(3-5-12)14-8-6-10(13)7-9-14;/h2-5,10H,6-9,13H2,1H3;1H.
What are the key properties of 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride?
1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)piperidin-4-amine;hydrochloride is sourced from PubChem (CID 57363410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).