N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide

C15H15ClN2O2 — CID 62946547

IUPACN-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1Oc1ccc(CN)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c1-10(19)18-14-4-2-3-5-15(14)20-12-7-6-11(9-17)13(16)8-12/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyISLCMSDRYLOMOA-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.55
Rot. Bonds4

About N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide

N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide (PubChem CID 62946547) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide
PubChem CID62946547
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1Oc1ccc(CN)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c1-10(19)18-14-4-2-3-5-15(14)20-12-7-6-11(9-17)13(16)8-12/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyISLCMSDRYLOMOA-UHFFFAOYSA-N
XLogP3.55
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide
CID 62502106
N-[2-[2-(aminomethyl)-6-methylphenoxy]phenyl]acetamide
CID 107105915
[2-chloro-4-(2-fluoro-3-methylphenoxy)phenyl]methanamine
CID 107655131
N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide
CID 48923418
[2-chloro-4-(2,3-difluorophenoxy)phenyl]methanamine
CID 55145340
N-[2-(4-formyl-3-methylphenoxy)phenyl]acetamide
CID 62134240
N-[2-[4-(aminomethyl)pyridazin-3-yl]oxyphenyl]acetamide
CID 80507952
3-(3-chloro-4-ethylphenyl)-1,1-dimethylurea;3-[2-(4-chlorophenoxy)phenyl]-1,1-dimethylurea
CID 21298998
[2-(3,4-dichlorophenoxy)phenyl]methanamine;hydrochloride
CID 19926666
(2-acetamidophenyl) hypochlorite
CID 150463309
N-[2-(3-bromo-4-cyanophenoxy)phenyl]acetamide
CID 107276937
4-(2-acetamidophenoxy)pyridine-2-carboxylic acid
CID 43142934

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide?
The IUPAC name of N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide (CID 62946547) is N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide is CC(=O)Nc1ccccc1Oc1ccc(CN)c(Cl)c1.
What is the InChIKey of N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide?
The InChIKey is ISLCMSDRYLOMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10(19)18-14-4-2-3-5-15(14)20-12-7-6-11(9-17)13(16)8-12/h2-8H,9,17H2,1H3,(H,18,19).
What are the key properties of N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide?
N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide is sourced from PubChem (CID 62946547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).