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

C9H15N5O — CID 79825795

IUPAC2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1ccc(N)c(N)n1
InChIInChI=1S/C9H15N5O/c1-14(2)8(15)5-12-7-4-3-6(10)9(11)13-7/h3-4H,5,10H2,1-2H3,(H3,11,12,13)
InChIKeyPHLXGHDRTZTPLG-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.25
Rot. Bonds3

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

2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide (PubChem CID 79825795) has the molecular formula C9H15N5O and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide
PubChem CID79825795
Molecular FormulaC9H15N5O
Molecular Weight209.25 g/mol
Exact Mass209.13
IUPAC Name2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1ccc(N)c(N)n1
InChIInChI=1S/C9H15N5O/c1-14(2)8(15)5-12-7-4-3-6(10)9(11)13-7/h3-4H,5,10H2,1-2H3,(H3,11,12,13)
InChIKeyPHLXGHDRTZTPLG-UHFFFAOYSA-N
XLogP-0.25
TPSA97.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-(2-methylidenebutyl)pyridine-2,3,6-triamine
CID 130608285
6-N-ethylpyridine-2,3,6-triamine
CID 79822372
6-N-[2-(dimethylamino)propyl]pyridine-2,3,6-triamine
CID 79828257
3-[(5,6-diamino-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
CID 106275362
2-(2-aminoanilino)-N,N-dimethylacetamide
CID 43310935
2-[(5-tert-butyl-2-pyridinyl)amino]-N,N-dimethylacetamide
CID 114011543
2-[(5,6-diamino-2-pyridinyl)amino]ethyl carbamate
CID 83201893
3-[(5,6-diamino-2-pyridinyl)amino]-2,2-dimethylpropan-1-ol
CID 115358122
6-N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2,3,6-triamine
CID 83116518
N,N-dimethyl-2-(pyridazin-3-ylamino)acetamide
CID 62482830
6-N-[2-(diethylamino)ethyl]pyridine-2,3,6-triamine
CID 79822537
2-[(5,6-diamino-2-pyridinyl)amino]-2-(hydroxymethyl)propane-1,3-diol
CID 107845614

Frequently Asked Questions

What is the IUPAC name of 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide (CID 79825795) is 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide is CN(C)C(=O)CNc1ccc(N)c(N)n1.
What is the InChIKey of 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide?
The InChIKey is PHLXGHDRTZTPLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O/c1-14(2)8(15)5-12-7-4-3-6(10)9(11)13-7/h3-4H,5,10H2,1-2H3,(H3,11,12,13).
What are the key properties of 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide?
2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide has a molecular weight of 209.25 g/mol, XLogP of -0.25, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5,6-diamino-2-pyridinyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 79825795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).