4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol

C15H18N2O2 — CID 67719526

IUPAC4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol
SMILESCc1ncc(COCc2ccccc2)c(CN)c1O
InChIInChI=1S/C15H18N2O2/c1-11-15(18)14(7-16)13(8-17-11)10-19-9-12-5-3-2-4-6-12/h2-6,8,18H,7,9-10,16H2,1H3
InChIKeyCUMOPPLRBOCZIK-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.27
Rot. Bonds5

About 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol

4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol (PubChem CID 67719526) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol.

Molecular Properties

Compound Name4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol
PubChem CID67719526
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol
SMILESCc1ncc(COCc2ccccc2)c(CN)c1O
InChIInChI=1S/C15H18N2O2/c1-11-15(18)14(7-16)13(8-17-11)10-19-9-12-5-3-2-4-6-12/h2-6,8,18H,7,9-10,16H2,1H3
InChIKeyCUMOPPLRBOCZIK-UHFFFAOYSA-N
XLogP2.27
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-2-methyl-5-(phenoxyphosphanyloxymethyl)pyridin-3-ol
CID 168931369
4-(aminomethyl)-5-(5-hydroxypentoxymethyl)-2-methylpyridin-3-ol
CID 139741281
[4-(aminomethyl)-5-hydroxy-6-methyl-3-pyridinyl]methyl methyl hydrogen phosphate
CID 59068359
5-[(4-methoxyphenyl)methoxymethyl]-2,4-dimethylpyridin-3-ol
CID 155358636
4-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methoxymethyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride
CID 171380537
[4-(hydroxymethyl)-6-methyl-5-phenylmethoxy-3-pyridinyl]methanol
CID 820399
ethane;phenylmethoxymethylbenzene
CID 90943549
benzyl N-[2,3-dihydroxy-3-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]propyl]carbamate
CID 171857335
bis[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methoxymethoxy]-oxophosphanium
CID 69100000
butyl (2S)-2-[[[4-(aminomethyl)-5-hydroxy-6-methyl-3-pyridinyl]methoxy-phenoxyphosphoryl]amino]propanoate
CID 176616199
butane;phenol;phenylmethoxymethylbenzene
CID 174556357
CID 66734377
CID 66734377

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol?
The IUPAC name of 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol (CID 67719526) is 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol.
What is the SMILES notation for 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol?
The canonical SMILES for 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol is Cc1ncc(COCc2ccccc2)c(CN)c1O.
What is the InChIKey of 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol?
The InChIKey is CUMOPPLRBOCZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-11-15(18)14(7-16)13(8-17-11)10-19-9-12-5-3-2-4-6-12/h2-6,8,18H,7,9-10,16H2,1H3.
What are the key properties of 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol?
4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol has a molecular weight of 258.32 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-2-methyl-5-(phenylmethoxymethyl)pyridin-3-ol is sourced from PubChem (CID 67719526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).