N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide

C17H20N2O3 — CID 43823143

IUPACN-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide
SMILESCOc1cccc(COCC(=O)Nc2cccc(CN)c2)c1
InChIInChI=1S/C17H20N2O3/c1-21-16-7-3-5-14(9-16)11-22-12-17(20)19-15-6-2-4-13(8-15)10-18/h2-9H,10-12,18H2,1H3,(H,19,20)
InChIKeyIDPFFWRCUIYPCY-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.31
Rot. Bonds7

About N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide

N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide (PubChem CID 43823143) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide
PubChem CID43823143
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide
SMILESCOc1cccc(COCC(=O)Nc2cccc(CN)c2)c1
InChIInChI=1S/C17H20N2O3/c1-21-16-7-3-5-14(9-16)11-22-12-17(20)19-15-6-2-4-13(8-15)10-18/h2-9H,10-12,18H2,1H3,(H,19,20)
InChIKeyIDPFFWRCUIYPCY-UHFFFAOYSA-N
XLogP2.31
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide
CID 24701706
N-(4-aminophenyl)-2-[(3-methoxyphenyl)methoxy]acetamide
CID 24708109
2-[(3-methoxyphenyl)methoxy]-N-(4-methylsulfanylphenyl)acetamide
CID 46493576
2-[4-(aminomethyl)phenoxy]-N-(3-methoxyphenyl)acetamide
CID 16795321
N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide
CID 16781265
N-[3-(aminomethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 16783753
(3-methoxyphenyl)methyl N-[4-(aminomethyl)phenyl]carbamate
CID 43309306
N-(3-hydroxyphenyl)-2-(3-methoxyphenyl)acetamide
CID 28739724
ethyl 4-[(3-methoxyphenyl)methoxy]-3-oxobutanoate
CID 63892220
N-[3-(bromomethyl)phenyl]-2-(3-methoxyphenyl)acetamide
CID 114307304
N-[3-(aminomethyl)phenyl]-2-(3-fluorophenoxy)acetamide
CID 16784462
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide?
The IUPAC name of N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide (CID 43823143) is N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide is COc1cccc(COCC(=O)Nc2cccc(CN)c2)c1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide?
The InChIKey is IDPFFWRCUIYPCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-21-16-7-3-5-14(9-16)11-22-12-17(20)19-15-6-2-4-13(8-15)10-18/h2-9H,10-12,18H2,1H3,(H,19,20).
What are the key properties of N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide?
N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide is sourced from PubChem (CID 43823143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).