2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide

C15H15ClN2O2 — CID 43282446

IUPAC2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide
SMILESCNCc1c(Cl)cccc1Oc1ccccc1C(N)=O
InChIInChI=1S/C15H15ClN2O2/c1-18-9-11-12(16)6-4-8-14(11)20-13-7-3-2-5-10(13)15(17)19/h2-8,18H,9H2,1H3,(H2,17,19)
InChIKeyJILHDTPMHZMWLD-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.95
Rot. Bonds5

About 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide

2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide (PubChem CID 43282446) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide.

Molecular Properties

Compound Name2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide
PubChem CID43282446
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide
SMILESCNCc1c(Cl)cccc1Oc1ccccc1C(N)=O
InChIInChI=1S/C15H15ClN2O2/c1-18-9-11-12(16)6-4-8-14(11)20-13-7-3-2-5-10(13)15(17)19/h2-8,18H,9H2,1H3,(H2,17,19)
InChIKeyJILHDTPMHZMWLD-UHFFFAOYSA-N
XLogP2.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-chloro-6-(2-iodophenoxy)phenyl]-N-methylmethanamine
CID 43479857
2-(3-chloro-2-formylphenoxy)benzamide
CID 28603903
ethyl 2-[3-chloro-2-(methylaminomethyl)phenoxy]pentanoate
CID 83037956
2-[2-chloro-4-(ethylaminomethyl)phenoxy]benzamide
CID 81144706
2-(3-chloro-2-nitrophenoxy)benzamide
CID 104835314
2-[(2-amino-6-chlorophenyl)methoxy]benzamide
CID 63745089
3-[3-chloro-2-(methylaminomethyl)phenoxy]butan-2-ol
CID 114318725
1-(2,6-dichlorophenyl)-N-methylmethanamine;ethane
CID 142839804
methyl 4-[3-chloro-2-(methylaminomethyl)phenoxy]butanoate
CID 114318736
N-[[2-chloro-6-(2-chlorophenoxy)phenyl]methyl]ethanamine
CID 43282972
2-benzyl-3-chlorobenzamide
CID 23225157
1-[2-chloro-6-(3,4-dichlorophenoxy)phenyl]-N-methylmethanamine
CID 63552208

Frequently Asked Questions

What is the IUPAC name of 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide?
The IUPAC name of 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide (CID 43282446) is 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide.
What is the SMILES notation for 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide?
The canonical SMILES for 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide is CNCc1c(Cl)cccc1Oc1ccccc1C(N)=O.
What is the InChIKey of 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide?
The InChIKey is JILHDTPMHZMWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-18-9-11-12(16)6-4-8-14(11)20-13-7-3-2-5-10(13)15(17)19/h2-8,18H,9H2,1H3,(H2,17,19).
What are the key properties of 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide?
2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide has a molecular weight of 290.75 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-2-(methylaminomethyl)phenoxy]benzamide is sourced from PubChem (CID 43282446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).