4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine

C18H21N7 — CID 19145545

IUPAC4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine
SMILESCN(C)Nc1ncnc(NN(c2ccccc2)c2ccccc2)c1N
InChIInChI=1S/C18H21N7/c1-24(2)22-17-16(19)18(21-13-20-17)23-25(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,19H2,1-2H3,(H2,20,21,22,23)
InChIKeyQNBBNPZKXMQZNU-UHFFFAOYSA-N
MW335.42 g/mol
LogP3.11
Rot. Bonds6

About 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine

4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine (PubChem CID 19145545) has the molecular formula C18H21N7 and a molecular weight of 335.42 g/mol. Its IUPAC name is 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine.

Molecular Properties

Compound Name4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine
PubChem CID19145545
Molecular FormulaC18H21N7
Molecular Weight335.42 g/mol
Exact Mass335.19
IUPAC Name4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine
SMILESCN(C)Nc1ncnc(NN(c2ccccc2)c2ccccc2)c1N
InChIInChI=1S/C18H21N7/c1-24(2)22-17-16(19)18(21-13-20-17)23-25(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,19H2,1-2H3,(H2,20,21,22,23)
InChIKeyQNBBNPZKXMQZNU-UHFFFAOYSA-N
XLogP3.11
TPSA82.34 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.42
LogP ≤ 53.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine?
The IUPAC name of 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine (CID 19145545) is 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine.
What is the SMILES notation for 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine?
The canonical SMILES for 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine is CN(C)Nc1ncnc(NN(c2ccccc2)c2ccccc2)c1N.
What is the InChIKey of 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine?
The InChIKey is QNBBNPZKXMQZNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7/c1-24(2)22-17-16(19)18(21-13-20-17)23-25(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,19H2,1-2H3,(H2,20,21,22,23).
What are the key properties of 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine?
4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine has a molecular weight of 335.42 g/mol, XLogP of 3.11, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine is sourced from PubChem (CID 19145545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).