2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide

C13H22N4O — CID 113408305

IUPAC2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)Nc1cc(N)c(C)cn1
InChIInChI=1S/C13H22N4O/c1-5-17(6-2)13(18)10(4)16-12-7-11(14)9(3)8-15-12/h7-8,10H,5-6H2,1-4H3,(H3,14,15,16)
InChIKeyLFODUSFMOBGIPG-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.64
Rot. Bonds5

About 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide

2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide (PubChem CID 113408305) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide
PubChem CID113408305
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)Nc1cc(N)c(C)cn1
InChIInChI=1S/C13H22N4O/c1-5-17(6-2)13(18)10(4)16-12-7-11(14)9(3)8-15-12/h7-8,10H,5-6H2,1-4H3,(H3,14,15,16)
InChIKeyLFODUSFMOBGIPG-UHFFFAOYSA-N
XLogP1.64
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide?
The IUPAC name of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide (CID 113408305) is 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide.
What is the SMILES notation for 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide?
The canonical SMILES for 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)Nc1cc(N)c(C)cn1.
What is the InChIKey of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide?
The InChIKey is LFODUSFMOBGIPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-5-17(6-2)13(18)10(4)16-12-7-11(14)9(3)8-15-12/h7-8,10H,5-6H2,1-4H3,(H3,14,15,16).
What are the key properties of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide?
2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide has a molecular weight of 250.35 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide is sourced from PubChem (CID 113408305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).