6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide

C15H25N3O — CID 47080109

IUPAC6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1ccc(N(CC)CC)nc1
InChIInChI=1S/C15H25N3O/c1-5-8-12(4)17-15(19)13-9-10-14(16-11-13)18(6-2)7-3/h9-12H,5-8H2,1-4H3,(H,17,19)
InChIKeyGUVOAUBQEXPYPD-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.85
Rot. Bonds7

About 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide

6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide (PubChem CID 47080109) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide
PubChem CID47080109
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1ccc(N(CC)CC)nc1
InChIInChI=1S/C15H25N3O/c1-5-8-12(4)17-15(19)13-9-10-14(16-11-13)18(6-2)7-3/h9-12H,5-8H2,1-4H3,(H,17,19)
InChIKeyGUVOAUBQEXPYPD-UHFFFAOYSA-N
XLogP2.85
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide?
The IUPAC name of 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide (CID 47080109) is 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide is CCCC(C)NC(=O)c1ccc(N(CC)CC)nc1.
What is the InChIKey of 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide?
The InChIKey is GUVOAUBQEXPYPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-8-12(4)17-15(19)13-9-10-14(16-11-13)18(6-2)7-3/h9-12H,5-8H2,1-4H3,(H,17,19).
What are the key properties of 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide?
6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 2.85, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylamino)-N-pentan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 47080109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).