N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide

C19H20N2O2 — CID 563605

IUPACN-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide
SMILESCC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
InChIInChI=1S/C19H20N2O2/c1-14(22)20-10-9-16-12-21-19-8-7-17(11-18(16)19)23-13-15-5-3-2-4-6-15/h2-8,11-12,21H,9-10,13H2,1H3,(H,20,22)
InChIKeyNYFDZJCKTLWFCP-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.43
Rot. Bonds6

About N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide

N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide (PubChem CID 563605) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide
PubChem CID563605
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide
SMILESCC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
InChIInChI=1S/C19H20N2O2/c1-14(22)20-10-9-16-12-21-19-8-7-17(11-18(16)19)23-13-15-5-3-2-4-6-15/h2-8,11-12,21H,9-10,13H2,1H3,(H,20,22)
InChIKeyNYFDZJCKTLWFCP-UHFFFAOYSA-N
XLogP3.43
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide?
The IUPAC name of N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide (CID 563605) is N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide is CC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12.
What is the InChIKey of N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide?
The InChIKey is NYFDZJCKTLWFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-14(22)20-10-9-16-12-21-19-8-7-17(11-18(16)19)23-13-15-5-3-2-4-6-15/h2-8,11-12,21H,9-10,13H2,1H3,(H,20,22).
What are the key properties of N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide?
N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide has a molecular weight of 308.38 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]acetamide is sourced from PubChem (CID 563605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).