N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide

C13H16N2O2 — CID 10513751

IUPACN-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide
SMILESCOc1cccc2[nH]c(CCNC(C)=O)cc12
InChIInChI=1S/C13H16N2O2/c1-9(16)14-7-6-10-8-11-12(15-10)4-3-5-13(11)17-2/h3-5,8,15H,6-7H2,1-2H3,(H,14,16)
InChIKeyWSJMNBNCQYFEFY-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.86
Rot. Bonds4

About N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide

N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide (PubChem CID 10513751) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide
PubChem CID10513751
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC NameN-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide
SMILESCOc1cccc2[nH]c(CCNC(C)=O)cc12
InChIInChI=1S/C13H16N2O2/c1-9(16)14-7-6-10-8-11-12(15-10)4-3-5-13(11)17-2/h3-5,8,15H,6-7H2,1-2H3,(H,14,16)
InChIKeyWSJMNBNCQYFEFY-UHFFFAOYSA-N
XLogP1.86
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(7-methoxy-1H-indol-2-yl)ethyl]acetamide
CID 10704742
2-(4-methoxy-1H-indol-2-yl)acetic acid
CID 28806414
N-[2-(1H-indol-2-yl)ethyl]acetamide
CID 10465460
1-(4-methoxy-1H-indol-2-yl)-2-methylpropan-2-ol
CID 117194596
4-methoxy-1H-indole-2-carbonyl chloride
CID 53404354
N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide;trihydrate
CID 70552532
N-hydroperoxy-4-methoxy-1H-indol-2-amine
CID 142093209
N-[(2R,3S)-3-hydroxy-1-oxo-1-(tridecylamino)butan-2-yl]-4-methoxy-1H-indole-2-carboxamide
CID 172948494
N-[2-(2-acetyl-5-methoxy-1H-indol-3-yl)ethyl]acetamide
CID 15382326
N'-(2-acetamidoethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]oxamide
CID 108506297
N-[3-[(2,3-dimethoxyphenyl)methylamino]propyl]acetamide
CID 82364656
N-[(2,6-dimethoxyphenyl)methyl]acetamide
CID 18718180

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide?
The IUPAC name of N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide (CID 10513751) is N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide is COc1cccc2[nH]c(CCNC(C)=O)cc12.
What is the InChIKey of N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide?
The InChIKey is WSJMNBNCQYFEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-9(16)14-7-6-10-8-11-12(15-10)4-3-5-13(11)17-2/h3-5,8,15H,6-7H2,1-2H3,(H,14,16).
What are the key properties of N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide?
N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide has a molecular weight of 232.28 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide is sourced from PubChem (CID 10513751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).