2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline

C15H19N3O — CID 81299989

IUPAC2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline
SMILESCOc1ccc(CN)c(N(C)Cc2ccccn2)c1
InChIInChI=1S/C15H19N3O/c1-18(11-13-5-3-4-8-17-13)15-9-14(19-2)7-6-12(15)10-16/h3-9H,10-11,16H2,1-2H3
InChIKeyGXKUWBYKMWTEJQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.19
Rot. Bonds5

About 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline

2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline (PubChem CID 81299989) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline.

Molecular Properties

Compound Name2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline
PubChem CID81299989
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline
SMILESCOc1ccc(CN)c(N(C)Cc2ccccn2)c1
InChIInChI=1S/C15H19N3O/c1-18(11-13-5-3-4-8-17-13)15-9-14(19-2)7-6-12(15)10-16/h3-9H,10-11,16H2,1-2H3
InChIKeyGXKUWBYKMWTEJQ-UHFFFAOYSA-N
XLogP2.19
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-4-ylmethyl)aniline
CID 81299898
2-(aminomethyl)-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]aniline
CID 81300114
[4-methoxy-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]phenyl]boronic acid
CID 65327432
2-(aminomethyl)-5-methoxy-N-(4-methoxyphenyl)-N-methylaniline
CID 81299533
2-[methyl(pyridin-2-ylmethyl)amino]phenol
CID 100991764
2-[(2,4-dimethoxyphenyl)methyl-(pyridin-2-ylmethyl)amino]ethanol
CID 111116702
4-(aminomethyl)-N-methyl-N-(pyridin-2-ylmethyl)pyridazin-3-amine
CID 80507638
5-methoxy-2-(pyridin-2-ylmethoxy)aniline
CID 16775223
4-methoxy-2-[methyl(2-pyridin-2-ylethyl)amino]benzenecarboximidamide
CID 81300119
2-(aminomethyl)-3-chloro-N-methyl-N-(pyridin-2-ylmethyl)aniline
CID 43565251
2-hydroxy-4-methoxy-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 43565722
3-methoxy-4-[[methyl(pyridin-2-ylmethyl)amino]methyl]aniline
CID 107208235

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline?
The IUPAC name of 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline (CID 81299989) is 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline.
What is the SMILES notation for 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline?
The canonical SMILES for 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline is COc1ccc(CN)c(N(C)Cc2ccccn2)c1.
What is the InChIKey of 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline?
The InChIKey is GXKUWBYKMWTEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18(11-13-5-3-4-8-17-13)15-9-14(19-2)7-6-12(15)10-16/h3-9H,10-11,16H2,1-2H3.
What are the key properties of 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline?
2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline has a molecular weight of 257.34 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-2-ylmethyl)aniline is sourced from PubChem (CID 81299989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).