5-(diethylamino)-N-phenylpyridine-2-carboxamide

C16H19N3O — CID 109194733

IUPAC5-(diethylamino)-N-phenylpyridine-2-carboxamide
SMILESCCN(CC)c1ccc(C(=O)Nc2ccccc2)nc1
InChIInChI=1S/C16H19N3O/c1-3-19(4-2)14-10-11-15(17-12-14)16(20)18-13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,18,20)
InChIKeyCFKJHGCZBMBVFD-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.18
Rot. Bonds5

About 5-(diethylamino)-N-phenylpyridine-2-carboxamide

5-(diethylamino)-N-phenylpyridine-2-carboxamide (PubChem CID 109194733) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-(diethylamino)-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(diethylamino)-N-phenylpyridine-2-carboxamide
PubChem CID109194733
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name5-(diethylamino)-N-phenylpyridine-2-carboxamide
SMILESCCN(CC)c1ccc(C(=O)Nc2ccccc2)nc1
InChIInChI=1S/C16H19N3O/c1-3-19(4-2)14-10-11-15(17-12-14)16(20)18-13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,18,20)
InChIKeyCFKJHGCZBMBVFD-UHFFFAOYSA-N
XLogP3.18
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(diethylamino)-N-phenylpyridine-2-carboxamide?
The IUPAC name of 5-(diethylamino)-N-phenylpyridine-2-carboxamide (CID 109194733) is 5-(diethylamino)-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 5-(diethylamino)-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 5-(diethylamino)-N-phenylpyridine-2-carboxamide is CCN(CC)c1ccc(C(=O)Nc2ccccc2)nc1.
What is the InChIKey of 5-(diethylamino)-N-phenylpyridine-2-carboxamide?
The InChIKey is CFKJHGCZBMBVFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-19(4-2)14-10-11-15(17-12-14)16(20)18-13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,18,20).
What are the key properties of 5-(diethylamino)-N-phenylpyridine-2-carboxamide?
5-(diethylamino)-N-phenylpyridine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylamino)-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109194733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).