2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide

C19H26N2O2 — CID 110681954

IUPAC2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide
SMILESCC(=O)N1CC(CC(=O)NC2CCCCCC2)c2ccccc21
InChIInChI=1S/C19H26N2O2/c1-14(22)21-13-15(17-10-6-7-11-18(17)21)12-19(23)20-16-8-4-2-3-5-9-16/h6-7,10-11,15-16H,2-5,8-9,12-13H2,1H3,(H,20,23)
InChIKeyUWNOFBPXDPNUOG-UHFFFAOYSA-N
MW314.43 g/mol
LogP3.37
Rot. Bonds3

About 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide

2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide (PubChem CID 110681954) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide.

Molecular Properties

Compound Name2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide
PubChem CID110681954
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide
SMILESCC(=O)N1CC(CC(=O)NC2CCCCCC2)c2ccccc21
InChIInChI=1S/C19H26N2O2/c1-14(22)21-13-15(17-10-6-7-11-18(17)21)12-19(23)20-16-8-4-2-3-5-9-16/h6-7,10-11,15-16H,2-5,8-9,12-13H2,1H3,(H,20,23)
InChIKeyUWNOFBPXDPNUOG-UHFFFAOYSA-N
XLogP3.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-acetyl-2,3-dihydroindol-3-yl)acetic acid
CID 44720734
2-(1-acetyl-2,3-dihydroindol-3-yl)-N-(4-ethylphenyl)acetamide
CID 110681975
1-[3-(trimethylsilylmethyl)-2,3-dihydroindol-1-yl]ethanone
CID 122202357
2-(1-acetyl-2,3-dihydroindol-3-yl)-N-[(2-chlorophenyl)methyl]acetamide
CID 110681932
N-cyclohexyl-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573809
2-(1-acetyl-2,3-dihydroindol-3-yl)-1-morpholin-4-ylethanone
CID 110681914
1-(2,7b-dihydro-1aH-oxireno[2,3-c]quinolin-3-yl)ethanone
CID 87624738
N-cycloheptyl-2-[(2R)-2-methyl-2,3-dihydro-1,4-benzothiazin-4-yl]acetamide
CID 92713130
1-[2-(cyclopentylamino)-2-oxoethyl]-2,3-dihydroindole-3-carboxylic acid
CID 80563640
N-cyclohexyl-4-methoxy-3,4-dihydro-2H-quinoline-1-carboxamide
CID 110746959
1-[1-(cyclopentylmethyl)-2,3-dihydroindol-3-yl]propan-2-one
CID 115106375
N-cycloheptyl-2-(3-oxo-1H-2-benzofuran-1-yl)acetamide
CID 42910502

Frequently Asked Questions

What is the IUPAC name of 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide?
The IUPAC name of 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide (CID 110681954) is 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide.
What is the SMILES notation for 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide?
The canonical SMILES for 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide is CC(=O)N1CC(CC(=O)NC2CCCCCC2)c2ccccc21.
What is the InChIKey of 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide?
The InChIKey is UWNOFBPXDPNUOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-14(22)21-13-15(17-10-6-7-11-18(17)21)12-19(23)20-16-8-4-2-3-5-9-16/h6-7,10-11,15-16H,2-5,8-9,12-13H2,1H3,(H,20,23).
What are the key properties of 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide?
2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide has a molecular weight of 314.43 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-acetyl-2,3-dihydroindol-3-yl)-N-cycloheptylacetamide is sourced from PubChem (CID 110681954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).