N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide

C13H20N4O2 — CID 119516391

IUPACN-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide
SMILESCCN(CC)C(=O)CCC(=O)Nc1ccc(N)nc1
InChIInChI=1S/C13H20N4O2/c1-3-17(4-2)13(19)8-7-12(18)16-10-5-6-11(14)15-9-10/h5-6,9H,3-4,7-8H2,1-2H3,(H2,14,15)(H,16,18)
InChIKeyFPSMUTKQROXJPL-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.25
Rot. Bonds6

About N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide

N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide (PubChem CID 119516391) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide
PubChem CID119516391
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide
SMILESCCN(CC)C(=O)CCC(=O)Nc1ccc(N)nc1
InChIInChI=1S/C13H20N4O2/c1-3-17(4-2)13(19)8-7-12(18)16-10-5-6-11(14)15-9-10/h5-6,9H,3-4,7-8H2,1-2H3,(H2,14,15)(H,16,18)
InChIKeyFPSMUTKQROXJPL-UHFFFAOYSA-N
XLogP1.25
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-amino-3-pyridinyl)-N',N'-diethylpentanediamide;hydrochloride
CID 119515259
N-(6-amino-3-pyridinyl)-N',N'-dipropylbutanediamide
CID 119515057
N-(6-amino-3-pyridinyl)-N',N'-dipropylpentanediamide
CID 119516549
N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
CID 119515208
N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
CID 119515078
N-(6-amino-3-pyridinyl)-3-(2-methylphenyl)propanamide
CID 62901141
N',N'-diethyl-N-pyrazin-2-ylbutanediamide
CID 75508705
N-(6-amino-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 119515818
N-(6-amino-3-pyridinyl)-2-cyclopropylacetamide
CID 62901685
N-(6-amino-3-pyridinyl)-2-ethoxypropanamide
CID 119516288
N-(6-amino-3-pyridinyl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide;hydrochloride
CID 119516505
N-(6-amino-3-pyridinyl)-2-(2-hydroxyphenyl)acetamide
CID 80741200

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide (CID 119516391) is N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide is CCN(CC)C(=O)CCC(=O)Nc1ccc(N)nc1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide?
The InChIKey is FPSMUTKQROXJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-3-17(4-2)13(19)8-7-12(18)16-10-5-6-11(14)15-9-10/h5-6,9H,3-4,7-8H2,1-2H3,(H2,14,15)(H,16,18).
What are the key properties of N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide?
N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide has a molecular weight of 264.33 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide is sourced from PubChem (CID 119516391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).