N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide

C17H15N3O — CID 50955108

IUPACN-ethyl-6-quinolin-6-ylpyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(-c2ccc3ncccc3c2)nc1
InChIInChI=1S/C17H15N3O/c1-2-18-17(21)14-6-8-16(20-11-14)13-5-7-15-12(10-13)4-3-9-19-15/h3-11H,2H2,1H3,(H,18,21)
InChIKeyGVXCYXTUSBYWGN-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.05
Rot. Bonds3

About N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide

N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide (PubChem CID 50955108) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-quinolin-6-ylpyridine-3-carboxamide
PubChem CID50955108
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-ethyl-6-quinolin-6-ylpyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(-c2ccc3ncccc3c2)nc1
InChIInChI=1S/C17H15N3O/c1-2-18-17(21)14-6-8-16(20-11-14)13-5-7-15-12(10-13)4-3-9-19-15/h3-11H,2H2,1H3,(H,18,21)
InChIKeyGVXCYXTUSBYWGN-UHFFFAOYSA-N
XLogP3.05
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide (CID 50955108) is N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide is CCNC(=O)c1ccc(-c2ccc3ncccc3c2)nc1.
What is the InChIKey of N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide?
The InChIKey is GVXCYXTUSBYWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-2-18-17(21)14-6-8-16(20-11-14)13-5-7-15-12(10-13)4-3-9-19-15/h3-11H,2H2,1H3,(H,18,21).
What are the key properties of N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide?
N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-quinolin-6-ylpyridine-3-carboxamide is sourced from PubChem (CID 50955108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).