N,N-diethylindole-1-carboxamide

C13H16N2O — CID 11160248

IUPACN,N-diethylindole-1-carboxamide
SMILESCCN(CC)C(=O)n1ccc2ccccc21
InChIInChI=1S/C13H16N2O/c1-3-14(4-2)13(16)15-10-9-11-7-5-6-8-12(11)15/h5-10H,3-4H2,1-2H3
InChIKeyDNEILLNCDATSFX-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.95
Rot. Bonds2

About N,N-diethylindole-1-carboxamide

N,N-diethylindole-1-carboxamide (PubChem CID 11160248) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is N,N-diethylindole-1-carboxamide.

Molecular Properties

Compound NameN,N-diethylindole-1-carboxamide
PubChem CID11160248
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC NameN,N-diethylindole-1-carboxamide
SMILESCCN(CC)C(=O)n1ccc2ccccc21
InChIInChI=1S/C13H16N2O/c1-3-14(4-2)13(16)15-10-9-11-7-5-6-8-12(11)15/h5-10H,3-4H2,1-2H3
InChIKeyDNEILLNCDATSFX-UHFFFAOYSA-N
XLogP2.95
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylindole-1-carboxamide?
The IUPAC name of N,N-diethylindole-1-carboxamide (CID 11160248) is N,N-diethylindole-1-carboxamide.
What is the SMILES notation for N,N-diethylindole-1-carboxamide?
The canonical SMILES for N,N-diethylindole-1-carboxamide is CCN(CC)C(=O)n1ccc2ccccc21.
What is the InChIKey of N,N-diethylindole-1-carboxamide?
The InChIKey is DNEILLNCDATSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-3-14(4-2)13(16)15-10-9-11-7-5-6-8-12(11)15/h5-10H,3-4H2,1-2H3.
What are the key properties of N,N-diethylindole-1-carboxamide?
N,N-diethylindole-1-carboxamide has a molecular weight of 216.28 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylindole-1-carboxamide is sourced from PubChem (CID 11160248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).