1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide

C13H18N2O — CID 144672537

IUPAC1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide
SMILESCCN1CCc2ccc(C(=O)N(C)C)cc21
InChIInChI=1S/C13H18N2O/c1-4-15-8-7-10-5-6-11(9-12(10)15)13(16)14(2)3/h5-6,9H,4,7-8H2,1-3H3
InChIKeySMKRTYBTBPHGFW-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.77
Rot. Bonds2

About 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide

1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide (PubChem CID 144672537) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide.

Molecular Properties

Compound Name1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide
PubChem CID144672537
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide
SMILESCCN1CCc2ccc(C(=O)N(C)C)cc21
InChIInChI=1S/C13H18N2O/c1-4-15-8-7-10-5-6-11(9-12(10)15)13(16)14(2)3/h5-6,9H,4,7-8H2,1-3H3
InChIKeySMKRTYBTBPHGFW-UHFFFAOYSA-N
XLogP1.77
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide?
The IUPAC name of 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide (CID 144672537) is 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide.
What is the SMILES notation for 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide?
The canonical SMILES for 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide is CCN1CCc2ccc(C(=O)N(C)C)cc21.
What is the InChIKey of 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide?
The InChIKey is SMKRTYBTBPHGFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-4-15-8-7-10-5-6-11(9-12(10)15)13(16)14(2)3/h5-6,9H,4,7-8H2,1-3H3.
What are the key properties of 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide?
1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide has a molecular weight of 218.30 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N,N-dimethyl-2,3-dihydroindole-6-carboxamide is sourced from PubChem (CID 144672537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).