1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine

C10H14N4O — CID 57422292

IUPAC1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine
SMILESCNc1cnn(Cc2c(C)noc2C)c1
InChIInChI=1S/C10H14N4O/c1-7-10(8(2)15-13-7)6-14-5-9(11-3)4-12-14/h4-5,11H,6H2,1-3H3
InChIKeyWDOYVPWJWBHTQN-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.58
Rot. Bonds3

About 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine

1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine (PubChem CID 57422292) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine.

Molecular Properties

Compound Name1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine
PubChem CID57422292
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine
SMILESCNc1cnn(Cc2c(C)noc2C)c1
InChIInChI=1S/C10H14N4O/c1-7-10(8(2)15-13-7)6-14-5-9(11-3)4-12-14/h4-5,11H,6H2,1-3H3
InChIKeyWDOYVPWJWBHTQN-UHFFFAOYSA-N
XLogP1.58
TPSA55.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine?
The IUPAC name of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine (CID 57422292) is 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine.
What is the SMILES notation for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine?
The canonical SMILES for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine is CNc1cnn(Cc2c(C)noc2C)c1.
What is the InChIKey of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine?
The InChIKey is WDOYVPWJWBHTQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-7-10(8(2)15-13-7)6-14-5-9(11-3)4-12-14/h4-5,11H,6H2,1-3H3.
What are the key properties of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine?
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine has a molecular weight of 206.25 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazol-4-amine is sourced from PubChem (CID 57422292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).