3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide

C11H19N5O — CID 106275362

IUPAC3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNc1ccc(N)c(N)n1
InChIInChI=1S/C11H19N5O/c1-11(2,10(17)14-3)6-15-8-5-4-7(12)9(13)16-8/h4-5H,6,12H2,1-3H3,(H,14,17)(H3,13,15,16)
InChIKeySZHDHCPQAFRORX-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.43
Rot. Bonds4

About 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide

3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide (PubChem CID 106275362) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide.

Molecular Properties

Compound Name3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
PubChem CID106275362
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNc1ccc(N)c(N)n1
InChIInChI=1S/C11H19N5O/c1-11(2,10(17)14-3)6-15-8-5-4-7(12)9(13)16-8/h4-5H,6,12H2,1-3H3,(H,14,17)(H3,13,15,16)
InChIKeySZHDHCPQAFRORX-UHFFFAOYSA-N
XLogP0.43
TPSA106.06 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(5,6-diamino-2-pyridinyl)amino]-2,2-dimethylpropan-1-ol
CID 115358122
3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
CID 106278300
3-[(5-amino-4-methyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
CID 106275327
3-[(6-hydrazinylpyrazin-2-yl)amino]-N,2,2-trimethylpropanamide
CID 106280881
6-N-ethylpyridine-2,3,6-triamine
CID 79822372
2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide
CID 79825795
4-amino-3-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]benzoic acid
CID 114167709
N,2,2-trimethyl-3-(pyrimidin-4-ylamino)propanamide
CID 106278325
6-N-(2-methylidenebutyl)pyridine-2,3,6-triamine
CID 130608285
2-amino-5-bromo-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]benzamide
CID 106278672
2-amino-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-5-methylbenzamide
CID 106274732
3-[(8-aminoquinolin-5-yl)amino]-N,2,2-trimethylpropanamide
CID 106275334

Frequently Asked Questions

What is the IUPAC name of 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
The IUPAC name of 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide (CID 106275362) is 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide.
What is the SMILES notation for 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
The canonical SMILES for 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide is CNC(=O)C(C)(C)CNc1ccc(N)c(N)n1.
What is the InChIKey of 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
The InChIKey is SZHDHCPQAFRORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-11(2,10(17)14-3)6-15-8-5-4-7(12)9(13)16-8/h4-5H,6,12H2,1-3H3,(H,14,17)(H3,13,15,16).
What are the key properties of 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide has a molecular weight of 237.31 g/mol, XLogP of 0.43, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide is sourced from PubChem (CID 106275362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).