N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide

C16H20N2O3 — CID 102712402

IUPACN-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
SMILESO=C1Cc2ccc(C(=O)NCCOC3CCCC3)cc2N1
InChIInChI=1S/C16H20N2O3/c19-15-10-11-5-6-12(9-14(11)18-15)16(20)17-7-8-21-13-3-1-2-4-13/h5-6,9,13H,1-4,7-8,10H2,(H,17,20)(H,18,19)
InChIKeyIRVIZLQHJSNEJY-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.87
Rot. Bonds5

About N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide

N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide (PubChem CID 102712402) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
PubChem CID102712402
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC NameN-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
SMILESO=C1Cc2ccc(C(=O)NCCOC3CCCC3)cc2N1
InChIInChI=1S/C16H20N2O3/c19-15-10-11-5-6-12(9-14(11)18-15)16(20)17-7-8-21-13-3-1-2-4-13/h5-6,9,13H,1-4,7-8,10H2,(H,17,20)(H,18,19)
InChIKeyIRVIZLQHJSNEJY-UHFFFAOYSA-N
XLogP1.87
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(cyclopropylmethoxy)ethyl]-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102737388
N-(2-cyclohexylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712046
N-(3-cyclopentylpropyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102737359
2-oxo-N-(3-propan-2-yloxypropyl)-1,3-dihydroindole-6-carboxamide
CID 102712158
N-butyl-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102711852
N-(2-cyclopropyl-2-hydroxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712371
ethyl 4-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]butanoate
CID 102712457
4-bromo-N-(2-cyclopentyloxyethyl)benzamide
CID 61149535
N-[(1-methylcyclopropyl)methyl]-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102737430
2-oxo-N-(piperidin-3-ylmethyl)-1,3-dihydroindole-6-carboxamide
CID 102711450
N-(2-cyclopentyloxyethyl)-4-fluoro-3-sulfanylbenzamide
CID 107030113
N-(2-cyclohexyloxyethyl)-4-sulfanylbenzamide
CID 107030134

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The IUPAC name of N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide (CID 102712402) is N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The canonical SMILES for N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide is O=C1Cc2ccc(C(=O)NCCOC3CCCC3)cc2N1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The InChIKey is IRVIZLQHJSNEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c19-15-10-11-5-6-12(9-14(11)18-15)16(20)17-7-8-21-13-3-1-2-4-13/h5-6,9,13H,1-4,7-8,10H2,(H,17,20)(H,18,19).
What are the key properties of N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide is sourced from PubChem (CID 102712402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).