4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol

C14H22N2O2 — CID 82297536

IUPAC4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol
SMILESCOc1ccc(C)cc1N1CCC(O)(CN)CC1
InChIInChI=1S/C14H22N2O2/c1-11-3-4-13(18-2)12(9-11)16-7-5-14(17,10-15)6-8-16/h3-4,9,17H,5-8,10,15H2,1-2H3
InChIKeyYLVQVRTXJGWZKJ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.29
Rot. Bonds3

About 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol

4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol (PubChem CID 82297536) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol
PubChem CID82297536
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol
SMILESCOc1ccc(C)cc1N1CCC(O)(CN)CC1
InChIInChI=1S/C14H22N2O2/c1-11-3-4-13(18-2)12(9-11)16-7-5-14(17,10-15)6-8-16/h3-4,9,17H,5-8,10,15H2,1-2H3
InChIKeyYLVQVRTXJGWZKJ-UHFFFAOYSA-N
XLogP1.29
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxy-5-methylphenyl)-4-methylpiperidine-4-carboxylic acid
CID 117011695
1-(2-methoxy-5-methylphenyl)-4-methylpiperazine
CID 20811370
4-(aminomethyl)-1-(3-methylphenyl)piperidin-4-ol
CID 82286378
3-amino-1-(2-methoxy-5-methylphenyl)pyrrolidine-3-carbonitrile
CID 117013000
4-(aminomethyl)-1-(2-methylphenyl)piperidin-4-ol
CID 82286374
1-(2-methoxy-5-methylphenyl)-4,4-dimethylpiperidin-3-one
CID 117025206
1-(2,5-dimethylphenyl)-4-(hydroxymethyl)piperidin-4-ol
CID 143566862
4-(aminomethyl)-1-(2-hydroxyphenyl)piperidin-4-ol
CID 115033365
4-(2-methoxy-5-methylphenyl)piperazine-2,6-dione
CID 55236738
1-ethyl-4-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-ol
CID 62161513
3-[(2-methoxy-5-methylphenyl)methyl]-1-methylpyrrolidin-3-ol
CID 55140625
1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine
CID 43315083

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol?
The IUPAC name of 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol (CID 82297536) is 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol.
What is the SMILES notation for 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol?
The canonical SMILES for 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol is COc1ccc(C)cc1N1CCC(O)(CN)CC1.
What is the InChIKey of 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol?
The InChIKey is YLVQVRTXJGWZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-3-4-13(18-2)12(9-11)16-7-5-14(17,10-15)6-8-16/h3-4,9,17H,5-8,10,15H2,1-2H3.
What are the key properties of 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol?
4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol has a molecular weight of 250.34 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-(2-methoxy-5-methylphenyl)piperidin-4-ol is sourced from PubChem (CID 82297536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).