2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide

C16H18N2O2 — CID 106486919

IUPAC2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide
SMILESCNCc1ccc(Oc2ccc(C(N)=O)c(C)c2)cc1
InChIInChI=1S/C16H18N2O2/c1-11-9-14(7-8-15(11)16(17)19)20-13-5-3-12(4-6-13)10-18-2/h3-9,18H,10H2,1-2H3,(H2,17,19)
InChIKeyFHKQPDWPPKAAJW-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.61
Rot. Bonds5

About 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide

2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide (PubChem CID 106486919) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide.

Molecular Properties

Compound Name2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide
PubChem CID106486919
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide
SMILESCNCc1ccc(Oc2ccc(C(N)=O)c(C)c2)cc1
InChIInChI=1S/C16H18N2O2/c1-11-9-14(7-8-15(11)16(17)19)20-13-5-3-12(4-6-13)10-18-2/h3-9,18H,10H2,1-2H3,(H2,17,19)
InChIKeyFHKQPDWPPKAAJW-UHFFFAOYSA-N
XLogP2.61
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-[4-(methylaminomethyl)phenoxy]pyridine-3-carboxamide
CID 106486726
2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide
CID 81275945
4-(4-amino-3-methylphenoxy)benzamide
CID 43381706
4-(hydroxymethyl)-2-methylbenzamide
CID 69484226
4-(4-ethylphenoxy)-N'-hydroxy-2-methylbenzenecarboximidamide
CID 81277675
3,5-dichloroaniline;2-methyl-4-phenoxybenzamide
CID 174930679
4-(4-ethoxyphenoxy)-2-methylbenzenecarbothioamide
CID 81277177
4-[4-[(propan-2-ylamino)methyl]phenoxy]benzamide
CID 43283523
2-methyl-5-phenoxybenzamide;hydrochloride
CID 174534962
1-[3-(3,4-dimethylphenoxy)-4-methylphenyl]-N-methylmethanamine
CID 105406718
4-(3-chloropropoxy)-2-methylbenzamide
CID 68504171
2-chloro-4-[4-(methylamino)phenoxy]benzamide
CID 62945399

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide?
The IUPAC name of 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide (CID 106486919) is 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide.
What is the SMILES notation for 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide?
The canonical SMILES for 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide is CNCc1ccc(Oc2ccc(C(N)=O)c(C)c2)cc1.
What is the InChIKey of 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide?
The InChIKey is FHKQPDWPPKAAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-9-14(7-8-15(11)16(17)19)20-13-5-3-12(4-6-13)10-18-2/h3-9,18H,10H2,1-2H3,(H2,17,19).
What are the key properties of 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide?
2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide is sourced from PubChem (CID 106486919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).