3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine

C10H12N4O — CID 106424548

IUPAC3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine
SMILESCNc1cncc(NCc2ccno2)c1
InChIInChI=1S/C10H12N4O/c1-11-8-4-9(6-12-5-8)13-7-10-2-3-14-15-10/h2-6,11,13H,7H2,1H3
InChIKeyVDCASXABJIYDPM-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.72
Rot. Bonds4

About 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine

3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine (PubChem CID 106424548) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine.

Molecular Properties

Compound Name3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine
PubChem CID106424548
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine
SMILESCNc1cncc(NCc2ccno2)c1
InChIInChI=1S/C10H12N4O/c1-11-8-4-9(6-12-5-8)13-7-10-2-3-14-15-10/h2-6,11,13H,7H2,1H3
InChIKeyVDCASXABJIYDPM-UHFFFAOYSA-N
XLogP1.72
TPSA62.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(1,2-oxazol-5-yl)methanamine
CID 23006271
3-N-methyl-5-N-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3,5-diamine
CID 104534362
2-[[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104532515
5-N-[(4-fluoro-3,5-dimethylphenyl)methyl]-3-N-methylpyridine-3,5-diamine
CID 104535355
3-N-methyl-5-N-[(3-methyl-2-pyridinyl)methyl]pyridine-3,5-diamine
CID 104534595
N-methyl-4-(1,2-oxazol-5-ylmethylamino)benzenesulfonamide
CID 114186437
N-(1,2-oxazol-5-ylmethyl)pyrazin-2-amine
CID 106419182
1-(1,2-oxazol-5-yl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 165349203
2-methyl-4-(1,2-oxazol-5-ylmethylamino)benzoic acid
CID 106419253
1-[2-amino-4-(1,2-oxazol-5-ylmethylamino)phenyl]ethanone
CID 106414616
4-methyl-2-N-(1,2-oxazol-5-ylmethyl)pyridine-2,5-diamine
CID 106414445
4-[[5-(methylamino)-3-pyridinyl]amino]butan-1-ol
CID 106846876

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine?
The IUPAC name of 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine (CID 106424548) is 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine.
What is the SMILES notation for 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine?
The canonical SMILES for 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine is CNc1cncc(NCc2ccno2)c1.
What is the InChIKey of 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine?
The InChIKey is VDCASXABJIYDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-11-8-4-9(6-12-5-8)13-7-10-2-3-14-15-10/h2-6,11,13H,7H2,1H3.
What are the key properties of 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine?
3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine has a molecular weight of 204.23 g/mol, XLogP of 1.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methyl-5-N-(1,2-oxazol-5-ylmethyl)pyridine-3,5-diamine is sourced from PubChem (CID 106424548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).