N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide

C11H14N2O2 — CID 64974739

IUPACN-ethoxy-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCONC(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C11H14N2O2/c1-2-15-13-11(14)9-3-4-10-8(7-9)5-6-12-10/h3-4,7,12H,2,5-6H2,1H3,(H,13,14)
InChIKeyZRGSUMIZJPWWLJ-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.34
Rot. Bonds3

About N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide

N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 64974739) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-ethoxy-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID64974739
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC NameN-ethoxy-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCONC(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C11H14N2O2/c1-2-15-13-11(14)9-3-4-10-8(7-9)5-6-12-10/h3-4,7,12H,2,5-6H2,1H3,(H,13,14)
InChIKeyZRGSUMIZJPWWLJ-UHFFFAOYSA-N
XLogP1.34
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-dihydro-1H-indole-5-carbonylamino)oxyacetic acid
CID 113498230
N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43142404
methyl 2-(2,3-dihydro-1H-indole-5-carbonylamino)propanoate
CID 60780386
N-pentyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142455
(2S)-2-(2,3-dihydro-1H-indole-5-carbonylamino)-3-methylpentanoic acid
CID 61174014
N-(2-acetamidoethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43552874
N-[(2S)-2-hydroxypropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93083353
1-(2,3-dihydro-1H-indol-5-yl)ethanone
CID 170999934
N-[2-[ethyl(methyl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 62641149
N-[2-(dimethylamino)-2-methylpropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 61247768
N-(2-hydroxy-2-methylbutyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 65106509
N-(2-methoxy-2-methylpropyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104761350

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide (CID 64974739) is N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide is CCONC(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is ZRGSUMIZJPWWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-2-15-13-11(14)9-3-4-10-8(7-9)5-6-12-10/h3-4,7,12H,2,5-6H2,1H3,(H,13,14).
What are the key properties of N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide?
N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 206.24 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 64974739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).