4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol

C13H20N2O — CID 82286378

IUPAC4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol
SMILESCc1cccc(N2CCC(O)(CN)CC2)c1
InChIInChI=1S/C13H20N2O/c1-11-3-2-4-12(9-11)15-7-5-13(16,10-14)6-8-15/h2-4,9,16H,5-8,10,14H2,1H3
InChIKeyCBNGYKYLJIQLTL-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.29
Rot. Bonds2

About 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol

4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol (PubChem CID 82286378) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol
PubChem CID82286378
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol
SMILESCc1cccc(N2CCC(O)(CN)CC2)c1
InChIInChI=1S/C13H20N2O/c1-11-3-2-4-12(9-11)15-7-5-13(16,10-14)6-8-15/h2-4,9,16H,5-8,10,14H2,1H3
InChIKeyCBNGYKYLJIQLTL-UHFFFAOYSA-N
XLogP1.29
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;4-methyl-1-(3-methylphenyl)piperidin-4-ol
CID 145068457
[4-(fluoromethyl)-1-(3-methylphenyl)piperidin-4-yl]methanamine
CID 115041666
4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]piperidin-4-ol
CID 62221487
[1-methyl-3-[4-(3-methylphenyl)piperazin-1-yl]pyrrolidin-3-yl]methanamine
CID 62975821
4-(aminomethyl)-1-(2-methylphenyl)piperidin-4-ol
CID 82286374
4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol
CID 82297536
4-(aminomethyl)-1-[4-(dimethylamino)phenyl]piperidin-4-ol
CID 82297182
1-[6-(hydroxymethyl)-4-[[4-hydroxy-1-(3-methylphenyl)piperidin-4-yl]methyl]-1,4-diazepan-1-yl]ethanone
CID 132765532
2-amino-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone;dihydrochloride
CID 119837589
1-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]cyclobutan-1-amine
CID 79844062
1-(3-methylphenyl)piperidine;propane
CID 143942273
1-(3-methylphenyl)-4-propylpiperazine
CID 44570658

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol?
The IUPAC name of 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol (CID 82286378) is 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol.
What is the SMILES notation for 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol?
The canonical SMILES for 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol is Cc1cccc(N2CCC(O)(CN)CC2)c1.
What is the InChIKey of 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol?
The InChIKey is CBNGYKYLJIQLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11-3-2-4-12(9-11)15-7-5-13(16,10-14)6-8-15/h2-4,9,16H,5-8,10,14H2,1H3.
What are the key properties of 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol?
4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol has a molecular weight of 220.32 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol is sourced from PubChem (CID 82286378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).