N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide

C17H26N2O — CID 106025969

IUPACN-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide
SMILESCCCCC(CCC)NC(=O)C1CNc2ccccc21
InChIInChI=1S/C17H26N2O/c1-3-5-9-13(8-4-2)19-17(20)15-12-18-16-11-7-6-10-14(15)16/h6-7,10-11,13,15,18H,3-5,8-9,12H2,1-2H3,(H,19,20)
InChIKeyRICVDHYYWNDILU-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.67
Rot. Bonds7

About N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide

N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide (PubChem CID 106025969) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide
PubChem CID106025969
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide
SMILESCCCCC(CCC)NC(=O)C1CNc2ccccc21
InChIInChI=1S/C17H26N2O/c1-3-5-9-13(8-4-2)19-17(20)15-12-18-16-11-7-6-10-14(15)16/h6-7,10-11,13,15,18H,3-5,8-9,12H2,1-2H3,(H,19,20)
InChIKeyRICVDHYYWNDILU-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide 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

Oxindole
CID 321710
Ropinirole Hydrochloride
CID 68727
(3Z)-3-[[4-(dimethylamino)phenyl]methylidene]-1H-indol-2-one
CID 6450842
3-Methyloxindole
CID 150923
3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-o-tolyl-propionamide
CID 721309
3-Benzyl-1,3-dihydroindol-2-one
CID 347328
1H-Indole-3-acetonitrile, 2,3-dihydro-2-oxo-
CID 98365
3,3-Dimethyl-1,3-dihydro-indol-2-one
CID 313100
3-[4-(Dimethylamino)benzylidene]indolin-2-one
CID 5353593
3-[4-(Dimethylamino)benzylidene]indolin-2-one
CID 5353593
2-(2-Amino-phenyl)-N-methyl-N-((S)-1-phenyl-2-pyrrolidin-1-yl-ethyl)-acetamide
CID 10090773
3-ethyl-3-{4-[4-(4-fluorophenyl)-piperazin-1-yl]-butyl}-1,3-dihydro-2H-indol-2-one
CID 24854187

Frequently Asked Questions

What is the IUPAC name of N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide?
The IUPAC name of N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide (CID 106025969) is N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide.
What is the SMILES notation for N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide?
The canonical SMILES for N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide is CCCCC(CCC)NC(=O)C1CNc2ccccc21.
What is the InChIKey of N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide?
The InChIKey is RICVDHYYWNDILU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-5-9-13(8-4-2)19-17(20)15-12-18-16-11-7-6-10-14(15)16/h6-7,10-11,13,15,18H,3-5,8-9,12H2,1-2H3,(H,19,20).
What are the key properties of N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide?
N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-octan-4-yl-2,3-dihydro-1H-indole-3-carboxamide is sourced from PubChem (CID 106025969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).