1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol

C14H22N2O — CID 55016646

IUPAC1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol
SMILESCc1ccc(C(CN)N2CCC(O)CC2)cc1
InChIInChI=1S/C14H22N2O/c1-11-2-4-12(5-3-11)14(10-15)16-8-6-13(17)7-9-16/h2-5,13-14,17H,6-10,15H2,1H3
InChIKeyUFOHUZPWIZTRAC-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.45
Rot. Bonds3

About 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol

1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol (PubChem CID 55016646) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol
PubChem CID55016646
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol
SMILESCc1ccc(C(CN)N2CCC(O)CC2)cc1
InChIInChI=1S/C14H22N2O/c1-11-2-4-12(5-3-11)14(10-15)16-8-6-13(17)7-9-16/h2-5,13-14,17H,6-10,15H2,1H3
InChIKeyUFOHUZPWIZTRAC-UHFFFAOYSA-N
XLogP1.45
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-amino-1-[4-(dimethylamino)phenyl]ethyl]piperidin-4-ol
CID 82020204
(2S)-2-(azepan-1-yl)-2-(4-methylphenyl)ethanamine
CID 9079311
1-[2-amino-1-(4-methylphenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63166318
2-(4-methylphenyl)-2-piperazin-1-ylethanamine
CID 82079666
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-(4-methylphenyl)ethanamine
CID 79175124
8-[2-amino-1-(4-methylphenyl)ethyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63764296
1-(2-amino-1-phenylethyl)pyrrolidin-3-ol
CID 62941324
2-(4-methylphenyl)-2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine
CID 62776010
2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-methylphenyl)ethanamine
CID 16642714
1-[2-amino-1-(4-methylphenyl)ethyl]-3-methylpyrrolidin-3-ol
CID 103355396
1-[2-amino-1-(4-bromophenyl)ethyl]-4-methylpiperidin-3-ol
CID 102956112
1-[1-[1-(4-methylphenyl)propyl]piperidin-4-yl]ethanamine
CID 55216289

Frequently Asked Questions

What is the IUPAC name of 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol?
The IUPAC name of 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol (CID 55016646) is 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol?
The canonical SMILES for 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol is Cc1ccc(C(CN)N2CCC(O)CC2)cc1.
What is the InChIKey of 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol?
The InChIKey is UFOHUZPWIZTRAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-2-4-12(5-3-11)14(10-15)16-8-6-13(17)7-9-16/h2-5,13-14,17H,6-10,15H2,1H3.
What are the key properties of 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol?
1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol has a molecular weight of 234.34 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol is sourced from PubChem (CID 55016646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).