1-(2,3-dihydroindol-1-yl)nonan-1-one

C17H25NO — CID 3742272

IUPAC1-(2,3-dihydroindol-1-yl)nonan-1-one
SMILESCCCCCCCCC(=O)N1CCc2ccccc21
InChIInChI=1S/C17H25NO/c1-2-3-4-5-6-7-12-17(19)18-14-13-15-10-8-9-11-16(15)18/h8-11H,2-7,12-14H2,1H3
InChIKeyFGCSNECBHGEKEE-UHFFFAOYSA-N
MW259.39 g/mol
LogP4.33
Rot. Bonds7

About 1-(2,3-dihydroindol-1-yl)nonan-1-one

1-(2,3-dihydroindol-1-yl)nonan-1-one (PubChem CID 3742272) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 1-(2,3-dihydroindol-1-yl)nonan-1-one.

Molecular Properties

Compound Name1-(2,3-dihydroindol-1-yl)nonan-1-one
PubChem CID3742272
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name1-(2,3-dihydroindol-1-yl)nonan-1-one
SMILESCCCCCCCCC(=O)N1CCc2ccccc21
InChIInChI=1S/C17H25NO/c1-2-3-4-5-6-7-12-17(19)18-14-13-15-10-8-9-11-16(15)18/h8-11H,2-7,12-14H2,1H3
InChIKeyFGCSNECBHGEKEE-UHFFFAOYSA-N
XLogP4.33
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2,3-dihydroindol-1-yl)nonan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,3-dihydroindol-1-yl)undecan-1-one
CID 4052782
1,6-bis(2,3-dihydroindol-1-yl)hexane-1,6-dione
CID 3096475
1-[6-(2,3-dihydroindol-1-yl)-6-oxohexyl]-3-octadecylurea
CID 23574254
6-(2,3-dihydroindol-1-yl)-6-oxohexanoic acid
CID 22906002
1,4-bis(2,3-dihydroindol-1-yl)butane-1,4-dione
CID 741114
1,9-bis(3,4-dihydro-2H-quinolin-1-yl)nonane-1,9-dione
CID 5158868
1-tetradecanoyl-2,3-dihydroquinolin-4-one
CID 57163991
[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-pentylazanium
CID 2443776
1-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)hexan-1-one
CID 55178426
N-[4-(2,3-dihydroindol-1-yl)-4-oxobutyl]acetamide
CID 47109240
1-(4-amino-2,3-dihydroindol-1-yl)nonan-1-one
CID 65448727
N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-N-pentylmethanesulfonamide
CID 113153451

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydroindol-1-yl)nonan-1-one?
The IUPAC name of 1-(2,3-dihydroindol-1-yl)nonan-1-one (CID 3742272) is 1-(2,3-dihydroindol-1-yl)nonan-1-one.
What is the SMILES notation for 1-(2,3-dihydroindol-1-yl)nonan-1-one?
The canonical SMILES for 1-(2,3-dihydroindol-1-yl)nonan-1-one is CCCCCCCCC(=O)N1CCc2ccccc21.
What is the InChIKey of 1-(2,3-dihydroindol-1-yl)nonan-1-one?
The InChIKey is FGCSNECBHGEKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-2-3-4-5-6-7-12-17(19)18-14-13-15-10-8-9-11-16(15)18/h8-11H,2-7,12-14H2,1H3.
What are the key properties of 1-(2,3-dihydroindol-1-yl)nonan-1-one?
1-(2,3-dihydroindol-1-yl)nonan-1-one has a molecular weight of 259.39 g/mol, XLogP of 4.33, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydroindol-1-yl)nonan-1-one is sourced from PubChem (CID 3742272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).