N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide

C11H16N2O2 — CID 117297795

IUPACN-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide
SMILESCOc1cccc(C(C)N)c1NC(C)=O
InChIInChI=1S/C11H16N2O2/c1-7(12)9-5-4-6-10(15-3)11(9)13-8(2)14/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeySIFJDRJAJJTQKT-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.67
Rot. Bonds3

About N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide

N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide (PubChem CID 117297795) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide
PubChem CID117297795
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide
SMILESCOc1cccc(C(C)N)c1NC(C)=O
InChIInChI=1S/C11H16N2O2/c1-7(12)9-5-4-6-10(15-3)11(9)13-8(2)14/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeySIFJDRJAJJTQKT-UHFFFAOYSA-N
XLogP1.67
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-acetamido-3-methoxyphenyl)-3-aminopropanoic acid
CID 117383613
N-[2-(3-aminobutyl)-6-methoxyphenyl]acetamide
CID 105497913
N-(2-acetyl-6-methoxyphenyl)acetamide
CID 117295660
N-[2-(1-aminocyclohexyl)-6-methoxyphenyl]acetamide
CID 117410781
methyl 2-[2-[(1R)-1-aminoethyl]phenoxy]propanoate
CID 63367072
2-acetamido-3-methoxy-N,N-dimethylbenzamide
CID 140972358
N-[2-methoxy-6-[2-(methylamino)acetyl]phenyl]acetamide
CID 105497642
methyl (2S)-2-(2-methoxyphenyl)propanoate
CID 12867082
N-[3-[1-(2-methoxyphenyl)ethylamino]phenyl]acetamide
CID 43193717
(1S,2R)-2-amino-1-(2-methoxyphenyl)propan-1-ol
CID 15671931
1-amino-1-(2-methoxyphenyl)-3-methylbutan-2-one
CID 166510839
methyl (2S,3R)-2-amino-3-hydroxy-3-(2-methoxyphenyl)propanoate
CID 11780290

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide?
The IUPAC name of N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide (CID 117297795) is N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide.
What is the SMILES notation for N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide?
The canonical SMILES for N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide is COc1cccc(C(C)N)c1NC(C)=O.
What is the InChIKey of N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide?
The InChIKey is SIFJDRJAJJTQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(12)9-5-4-6-10(15-3)11(9)13-8(2)14/h4-7H,12H2,1-3H3,(H,13,14).
What are the key properties of N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide?
N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide has a molecular weight of 208.26 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-aminoethyl)-6-methoxyphenyl]acetamide is sourced from PubChem (CID 117297795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).