2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide

C25H24N6O — CID 122314152

IUPAC2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide
SMILESO=C(NCCNc1cc(Nc2ccccn2)ncn1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H24N6O/c32-25(24(19-9-3-1-4-10-19)20-11-5-2-6-12-20)28-16-15-27-22-17-23(30-18-29-22)31-21-13-7-8-14-26-21/h1-14,17-18,24H,15-16H2,(H,28,32)(H2,26,27,29,30,31)
InChIKeyLUWZTDKOHPCLBF-UHFFFAOYSA-N
MW424.51 g/mol
LogP3.98
Rot. Bonds9

About 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide

2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide (PubChem CID 122314152) has the molecular formula C25H24N6O and a molecular weight of 424.51 g/mol. Its IUPAC name is 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide
PubChem CID122314152
Molecular FormulaC25H24N6O
Molecular Weight424.51 g/mol
Exact Mass424.20
IUPAC Name2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide
SMILESO=C(NCCNc1cc(Nc2ccccn2)ncn1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H24N6O/c32-25(24(19-9-3-1-4-10-19)20-11-5-2-6-12-20)28-16-15-27-22-17-23(30-18-29-22)31-21-13-7-8-14-26-21/h1-14,17-18,24H,15-16H2,(H,28,32)(H2,26,27,29,30,31)
InChIKeyLUWZTDKOHPCLBF-UHFFFAOYSA-N
XLogP3.98
TPSA91.83 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.51
LogP ≤ 53.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]butanamide
CID 71800128
N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]butanamide
CID 122314104
N-[2-[[6-[(4-methyl-2-pyridinyl)amino]pyridazin-3-yl]amino]ethyl]-2,2-diphenylacetamide
CID 121064588
N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]quinoxaline-6-carboxamide
CID 122314374
N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]-1,3-benzothiazole-2-carboxamide
CID 122314294
(E)-3-(2-methylphenyl)-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]prop-2-enamide
CID 122314391
N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]quinoline-2-carboxamide
CID 122314258
1-(4-methoxy-2-methylphenyl)-3-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]urea
CID 71800240
N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]-4-pyrrol-1-ylbenzamide
CID 122314351
N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]-1-benzofuran-2-carboxamide
CID 122314281
2-oxo-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]chromene-3-carboxamide
CID 122314157
6-N-[3-(methylamino)propyl]-4-N-pyridin-2-ylpyrimidine-4,6-diamine
CID 115263939

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide?
The IUPAC name of 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide (CID 122314152) is 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide.
What is the SMILES notation for 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide?
The canonical SMILES for 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide is O=C(NCCNc1cc(Nc2ccccn2)ncn1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide?
The InChIKey is LUWZTDKOHPCLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O/c32-25(24(19-9-3-1-4-10-19)20-11-5-2-6-12-20)28-16-15-27-22-17-23(30-18-29-22)31-21-13-7-8-14-26-21/h1-14,17-18,24H,15-16H2,(H,28,32)(H2,26,27,29,30,31).
What are the key properties of 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide?
2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide has a molecular weight of 424.51 g/mol, XLogP of 3.98, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-[2-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]ethyl]acetamide is sourced from PubChem (CID 122314152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).