6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine

C14H22N6O — CID 106390425

IUPAC6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
SMILESCc1cnc(C(C)Nc2nc(C(C)C)nc(NN)c2C)o1
InChIInChI=1S/C14H22N6O/c1-7(2)11-18-12(9(4)13(19-11)20-15)17-10(5)14-16-6-8(3)21-14/h6-7,10H,15H2,1-5H3,(H2,17,18,19,20)
InChIKeyLRYHYCUCRCFTBX-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.66
Rot. Bonds5

About 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine (PubChem CID 106390425) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
PubChem CID106390425
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
SMILESCc1cnc(C(C)Nc2nc(C(C)C)nc(NN)c2C)o1
InChIInChI=1S/C14H22N6O/c1-7(2)11-18-12(9(4)13(19-11)20-15)17-10(5)14-16-6-8(3)21-14/h6-7,10H,15H2,1-5H3,(H2,17,18,19,20)
InChIKeyLRYHYCUCRCFTBX-UHFFFAOYSA-N
XLogP2.66
TPSA101.89 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine (CID 106390425) is 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine is Cc1cnc(C(C)Nc2nc(C(C)C)nc(NN)c2C)o1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is LRYHYCUCRCFTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-7(2)11-18-12(9(4)13(19-11)20-15)17-10(5)14-16-6-8(3)21-14/h6-7,10H,15H2,1-5H3,(H2,17,18,19,20).
What are the key properties of 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 290.37 g/mol, XLogP of 2.66, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 106390425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).