2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide

C17H19N3O — CID 80572253

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide
SMILESO=C(CC1CNc2ccccc21)NCCc1ccncc1
InChIInChI=1S/C17H19N3O/c21-17(19-10-7-13-5-8-18-9-6-13)11-14-12-20-16-4-2-1-3-15(14)16/h1-6,8-9,14,20H,7,10-12H2,(H,19,21)
InChIKeyUJTRFCCSGMUOLR-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.34
Rot. Bonds5

About 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide

2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide (PubChem CID 80572253) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide
PubChem CID80572253
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide
SMILESO=C(CC1CNc2ccccc21)NCCc1ccncc1
InChIInChI=1S/C17H19N3O/c21-17(19-10-7-13-5-8-18-9-6-13)11-14-12-20-16-4-2-1-3-15(14)16/h1-6,8-9,14,20H,7,10-12H2,(H,19,21)
InChIKeyUJTRFCCSGMUOLR-UHFFFAOYSA-N
XLogP2.34
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1H-indol-3-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 80573900
2-(2,3-dihydro-1H-indol-3-yl)-N-[2-(1H-imidazol-5-yl)ethyl]acetamide
CID 80573485
N-(2-cyclopropylethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573388
2-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-(2-pyridin-4-ylethyl)acetamide
CID 97149134
2-(2,3-dihydro-1H-indol-3-yl)-N-pentylacetamide
CID 80573792
2-(2,3-dihydro-1H-indol-3-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
CID 80572556
2-(2,3-dihydro-1H-indol-3-yl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 80572684
2-[[2-(2,3-dihydro-1H-indol-3-yl)acetyl]amino]acetic acid
CID 80573099
2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyrrol-1-ylethyl)acetamide
CID 106390914
2-(2,3-dihydro-1H-indol-3-yl)-N-octylacetamide
CID 115567924
N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573936
2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide
CID 114332228

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide (CID 80572253) is 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide is O=C(CC1CNc2ccccc21)NCCc1ccncc1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide?
The InChIKey is UJTRFCCSGMUOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c21-17(19-10-7-13-5-8-18-9-6-13)11-14-12-20-16-4-2-1-3-15(14)16/h1-6,8-9,14,20H,7,10-12H2,(H,19,21).
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide?
2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 2.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide is sourced from PubChem (CID 80572253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).