2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine

C20H22N4 — CID 112916665

IUPAC2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
SMILESCc1cc(NC(C)c2ccccc2)nc(N(C)c2ccccc2)n1
InChIInChI=1S/C20H22N4/c1-15-14-19(22-16(2)17-10-6-4-7-11-17)23-20(21-15)24(3)18-12-8-5-9-13-18/h4-14,16H,1-3H3,(H,21,22,23)
InChIKeySLFFUULAIJAPPA-UHFFFAOYSA-N
MW318.42 g/mol
LogP4.73
Rot. Bonds5

About 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine

2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine (PubChem CID 112916665) has the molecular formula C20H22N4 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
PubChem CID112916665
Molecular FormulaC20H22N4
Molecular Weight318.42 g/mol
Exact Mass318.18
IUPAC Name2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
SMILESCc1cc(NC(C)c2ccccc2)nc(N(C)c2ccccc2)n1
InChIInChI=1S/C20H22N4/c1-15-14-19(22-16(2)17-10-6-4-7-11-17)23-20(21-15)24(3)18-12-8-5-9-13-18/h4-14,16H,1-3H3,(H,21,22,23)
InChIKeySLFFUULAIJAPPA-UHFFFAOYSA-N
XLogP4.73
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine 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

4-N-(3,4-dichlorophenyl)-2-N,6-dimethyl-2-N-phenylpyrimidine-2,4-diamine
CID 112927646
4-[[6-methyl-2-(N-methylanilino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 166329636
2-N-butan-2-yl-6-methyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 112909060
4-N-[3-(dimethylamino)propyl]-2-N,6-dimethyl-2-N-phenylpyrimidine-2,4-diamine
CID 112913498
2-N,6-dimethyl-4-N-pentyl-2-N-phenylpyrimidine-2,4-diamine
CID 112925381
6-methyl-2-N-[(2-methylphenyl)methyl]-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 112915922
4-N-ethyl-2-methyl-4-N-phenyl-6-N-(1-phenylethyl)pyrimidine-4,6-diamine
CID 112872102
2-N-(3-chloro-4-methylphenyl)-6-methyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 112916687
2-N,2-N,6-trimethyl-4-N-propan-2-ylpyrimidine-2,4-diamine
CID 83698650
2-N-(5-chloro-2-methylphenyl)-6-methyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 112916685
4-N-tert-butyl-2-methyl-6-N-(1-phenylethyl)pyrimidine-4,6-diamine
CID 112872076
N-[1-(4-methoxyphenyl)ethyl]-2,6-dimethylpyrimidin-4-amine
CID 62047830

Frequently Asked Questions

What is the IUPAC name of 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine (CID 112916665) is 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine is Cc1cc(NC(C)c2ccccc2)nc(N(C)c2ccccc2)n1.
What is the InChIKey of 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine?
The InChIKey is SLFFUULAIJAPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4/c1-15-14-19(22-16(2)17-10-6-4-7-11-17)23-20(21-15)24(3)18-12-8-5-9-13-18/h4-14,16H,1-3H3,(H,21,22,23).
What are the key properties of 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine?
2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine has a molecular weight of 318.42 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-dimethyl-2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 112916665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).