2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide

C10H13N5O — CID 103468133

IUPAC2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide
SMILESCC(C)(Nc1ccc(N)c(C#N)n1)C(N)=O
InChIInChI=1S/C10H13N5O/c1-10(2,9(13)16)15-8-4-3-6(12)7(5-11)14-8/h3-4H,12H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeySXFRIHJLBKUVBG-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.21
Rot. Bonds3

About 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide

2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide (PubChem CID 103468133) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide
PubChem CID103468133
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide
SMILESCC(C)(Nc1ccc(N)c(C#N)n1)C(N)=O
InChIInChI=1S/C10H13N5O/c1-10(2,9(13)16)15-8-4-3-6(12)7(5-11)14-8/h3-4H,12H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeySXFRIHJLBKUVBG-UHFFFAOYSA-N
XLogP0.21
TPSA117.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-6-[(3-hydroxy-2,3-dimethylbutan-2-yl)amino]pyridine-2-carbonitrile
CID 106183703
3-amino-6-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]pyridine-2-carbonitrile
CID 107845785
3-amino-6-[(2-hydroxy-3-methoxypropyl)amino]pyridine-2-carbonitrile
CID 103468525
3-amino-6-(2-hydroxyethylamino)pyridine-2-carbonitrile
CID 103467344
3-amino-6-(2,2-difluoroethylamino)pyridine-2-carbonitrile
CID 103468887
3-amino-6-[(3-hydroxy-4-methoxybutyl)amino]pyridine-2-carbonitrile
CID 106243451
3-amino-6-[(3-hydroxy-2-methylpropyl)amino]pyridine-2-carbonitrile
CID 103468594
3-amino-6-(3-hydroxybutylamino)pyridine-2-carbonitrile
CID 103468589
3-amino-6-[2-(2-hydroxyethoxy)ethylamino]pyridine-2-carbonitrile
CID 103468258
3-amino-6-(2-methylsulfanylpropylamino)pyridine-2-carbonitrile
CID 103469096
3-amino-6-[(1-hydroxycyclobutyl)methylamino]pyridine-2-carbonitrile
CID 103469214
2-[(5-amino-6-cyano-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
CID 103469330

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide?
The IUPAC name of 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide (CID 103468133) is 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide.
What is the SMILES notation for 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide?
The canonical SMILES for 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide is CC(C)(Nc1ccc(N)c(C#N)n1)C(N)=O.
What is the InChIKey of 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide?
The InChIKey is SXFRIHJLBKUVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-10(2,9(13)16)15-8-4-3-6(12)7(5-11)14-8/h3-4H,12H2,1-2H3,(H2,13,16)(H,14,15).
What are the key properties of 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide?
2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide has a molecular weight of 219.25 g/mol, XLogP of 0.21, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-cyano-2-pyridinyl)amino]-2-methylpropanamide is sourced from PubChem (CID 103468133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).