2,2-diethyl-3H-pyridine-6-carboxamide

C10H16N2O — CID 175290556

IUPAC2,2-diethyl-3H-pyridine-6-carboxamide
SMILESCCC1(CC)CC=CC(C(N)=O)=N1
InChIInChI=1S/C10H16N2O/c1-3-10(4-2)7-5-6-8(12-10)9(11)13/h5-6H,3-4,7H2,1-2H3,(H2,11,13)
InChIKeyZJNRBGGAVIPUSF-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.43
Rot. Bonds3

About 2,2-diethyl-3H-pyridine-6-carboxamide

2,2-diethyl-3H-pyridine-6-carboxamide (PubChem CID 175290556) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2,2-diethyl-3H-pyridine-6-carboxamide.

Molecular Properties

Compound Name2,2-diethyl-3H-pyridine-6-carboxamide
PubChem CID175290556
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2,2-diethyl-3H-pyridine-6-carboxamide
SMILESCCC1(CC)CC=CC(C(N)=O)=N1
InChIInChI=1S/C10H16N2O/c1-3-10(4-2)7-5-6-8(12-10)9(11)13/h5-6H,3-4,7H2,1-2H3,(H2,11,13)
InChIKeyZJNRBGGAVIPUSF-UHFFFAOYSA-N
XLogP1.43
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-3H-pyridine-6-carboxamide?
The IUPAC name of 2,2-diethyl-3H-pyridine-6-carboxamide (CID 175290556) is 2,2-diethyl-3H-pyridine-6-carboxamide.
What is the SMILES notation for 2,2-diethyl-3H-pyridine-6-carboxamide?
The canonical SMILES for 2,2-diethyl-3H-pyridine-6-carboxamide is CCC1(CC)CC=CC(C(N)=O)=N1.
What is the InChIKey of 2,2-diethyl-3H-pyridine-6-carboxamide?
The InChIKey is ZJNRBGGAVIPUSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-3-10(4-2)7-5-6-8(12-10)9(11)13/h5-6H,3-4,7H2,1-2H3,(H2,11,13).
What are the key properties of 2,2-diethyl-3H-pyridine-6-carboxamide?
2,2-diethyl-3H-pyridine-6-carboxamide has a molecular weight of 180.25 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-3H-pyridine-6-carboxamide is sourced from PubChem (CID 175290556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).