3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide

C10H16N4O — CID 106280453

IUPAC3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNc1cccc(N)n1)C(N)=O
InChIInChI=1S/C10H16N4O/c1-10(2,9(12)15)6-13-8-5-3-4-7(11)14-8/h3-5H,6H2,1-2H3,(H2,12,15)(H3,11,13,14)
InChIKeyMNDXRBJMQSGADN-UHFFFAOYSA-N
MW208.27 g/mol
LogP0.59
Rot. Bonds4

About 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide

3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide (PubChem CID 106280453) has the molecular formula C10H16N4O and a molecular weight of 208.27 g/mol. Its IUPAC name is 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide
PubChem CID106280453
Molecular FormulaC10H16N4O
Molecular Weight208.27 g/mol
Exact Mass208.13
IUPAC Name3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNc1cccc(N)n1)C(N)=O
InChIInChI=1S/C10H16N4O/c1-10(2,9(12)15)6-13-8-5-3-4-7(11)14-8/h3-5H,6H2,1-2H3,(H2,12,15)(H3,11,13,14)
InChIKeyMNDXRBJMQSGADN-UHFFFAOYSA-N
XLogP0.59
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide (CID 106280453) is 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide is CC(C)(CNc1cccc(N)n1)C(N)=O.
What is the InChIKey of 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide?
The InChIKey is MNDXRBJMQSGADN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-10(2,9(12)15)6-13-8-5-3-4-7(11)14-8/h3-5H,6H2,1-2H3,(H2,12,15)(H3,11,13,14).
What are the key properties of 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide?
3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide has a molecular weight of 208.27 g/mol, XLogP of 0.59, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 106280453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).