6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine

C21H19N7 — CID 19145412

IUPAC6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine
SMILESNc1c(Nc2cccnc2)ncnc1NN(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H19N7/c22-19-20(26-16-8-7-13-23-14-16)24-15-25-21(19)27-28(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H,22H2,(H2,24,25,26,27)
InChIKeyRGTCGYUNZMSZDG-UHFFFAOYSA-N
MW369.43 g/mol
LogP4.36
Rot. Bonds6

About 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine

6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine (PubChem CID 19145412) has the molecular formula C21H19N7 and a molecular weight of 369.43 g/mol. Its IUPAC name is 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine.

Molecular Properties

Compound Name6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine
PubChem CID19145412
Molecular FormulaC21H19N7
Molecular Weight369.43 g/mol
Exact Mass369.17
IUPAC Name6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine
SMILESNc1c(Nc2cccnc2)ncnc1NN(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H19N7/c22-19-20(26-16-8-7-13-23-14-16)24-15-25-21(19)27-28(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H,22H2,(H2,24,25,26,27)
InChIKeyRGTCGYUNZMSZDG-UHFFFAOYSA-N
XLogP4.36
TPSA91.99 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 54.36
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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Related Compounds

4-N-(3,4-dimethylphenyl)-6-(2,2-diphenylhydrazinyl)pyrimidine-4,5-diamine
CID 22546221
4-N-(3,5-dimethylphenyl)-6-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 22540968
4-(2,2-dimethylhydrazinyl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine
CID 19145545
6-N-(3-chlorophenyl)-4-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 19145427
6-(2,2-diphenylhydrazinyl)-4-N-(5-methyl-2-pyridinyl)pyrimidine-4,5-diamine
CID 19146654
6-propan-2-yloxy-4-N-pyridin-3-ylpyrimidine-4,5-diamine
CID 19145475
6-N-(4-propan-2-ylphenyl)-4-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 22547831
6-N-pyridin-3-yl-4-N-quinolin-5-ylpyrimidine-4,5,6-triamine
CID 19145481
4-N-(2,5-difluorophenyl)-6-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 19145503
4-N-(5-methyl-2-pyridinyl)-6-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 19145493
6-N-(3-chloro-4-fluorophenyl)-4-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 19145485
N-pyridin-3-ylquinazolin-4-amine
CID 5328017

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine?
The IUPAC name of 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine (CID 19145412) is 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine.
What is the SMILES notation for 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine?
The canonical SMILES for 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine is Nc1c(Nc2cccnc2)ncnc1NN(c1ccccc1)c1ccccc1.
What is the InChIKey of 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine?
The InChIKey is RGTCGYUNZMSZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N7/c22-19-20(26-16-8-7-13-23-14-16)24-15-25-21(19)27-28(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H,22H2,(H2,24,25,26,27).
What are the key properties of 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine?
6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine has a molecular weight of 369.43 g/mol, XLogP of 4.36, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-diphenylhydrazinyl)-4-N-pyridin-3-ylpyrimidine-4,5-diamine is sourced from PubChem (CID 19145412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).