N-ethyl-N,2,6-trimethylquinoline-4-carboxamide

C15H18N2O — CID 134005674

IUPACN-ethyl-N,2,6-trimethylquinoline-4-carboxamide
SMILESCCN(C)C(=O)c1cc(C)nc2ccc(C)cc12
InChIInChI=1S/C15H18N2O/c1-5-17(4)15(18)13-9-11(3)16-14-7-6-10(2)8-12(13)14/h6-9H,5H2,1-4H3
InChIKeyYDHJVMAGIROQRS-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.94
Rot. Bonds2

About N-ethyl-N,2,6-trimethylquinoline-4-carboxamide

N-ethyl-N,2,6-trimethylquinoline-4-carboxamide (PubChem CID 134005674) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-ethyl-N,2,6-trimethylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,2,6-trimethylquinoline-4-carboxamide
PubChem CID134005674
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-ethyl-N,2,6-trimethylquinoline-4-carboxamide
SMILESCCN(C)C(=O)c1cc(C)nc2ccc(C)cc12
InChIInChI=1S/C15H18N2O/c1-5-17(4)15(18)13-9-11(3)16-14-7-6-10(2)8-12(13)14/h6-9H,5H2,1-4H3
InChIKeyYDHJVMAGIROQRS-UHFFFAOYSA-N
XLogP2.94
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2,6-trimethylquinoline-4-carboxamide?
The IUPAC name of N-ethyl-N,2,6-trimethylquinoline-4-carboxamide (CID 134005674) is N-ethyl-N,2,6-trimethylquinoline-4-carboxamide.
What is the SMILES notation for N-ethyl-N,2,6-trimethylquinoline-4-carboxamide?
The canonical SMILES for N-ethyl-N,2,6-trimethylquinoline-4-carboxamide is CCN(C)C(=O)c1cc(C)nc2ccc(C)cc12.
What is the InChIKey of N-ethyl-N,2,6-trimethylquinoline-4-carboxamide?
The InChIKey is YDHJVMAGIROQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-5-17(4)15(18)13-9-11(3)16-14-7-6-10(2)8-12(13)14/h6-9H,5H2,1-4H3.
What are the key properties of N-ethyl-N,2,6-trimethylquinoline-4-carboxamide?
N-ethyl-N,2,6-trimethylquinoline-4-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2,6-trimethylquinoline-4-carboxamide is sourced from PubChem (CID 134005674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).