2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine

C18H18N4 — CID 781073

IUPAC2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine
SMILESCN(C)c1nc(-c2ccccc2)c(N)c(-c2ccccc2)n1
InChIInChI=1S/C18H18N4/c1-22(2)18-20-16(13-9-5-3-6-10-13)15(19)17(21-18)14-11-7-4-8-12-14/h3-12H,19H2,1-2H3
InChIKeyXGXDOILAGPABMO-UHFFFAOYSA-N
MW290.37 g/mol
LogP3.46
Rot. Bonds3

About 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine

2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine (PubChem CID 781073) has the molecular formula C18H18N4 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine
PubChem CID781073
Molecular FormulaC18H18N4
Molecular Weight290.37 g/mol
Exact Mass290.15
IUPAC Name2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine
SMILESCN(C)c1nc(-c2ccccc2)c(N)c(-c2ccccc2)n1
InChIInChI=1S/C18H18N4/c1-22(2)18-20-16(13-9-5-3-6-10-13)15(19)17(21-18)14-11-7-4-8-12-14/h3-12H,19H2,1-2H3
InChIKeyXGXDOILAGPABMO-UHFFFAOYSA-N
XLogP3.46
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine?
The IUPAC name of 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine (CID 781073) is 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine is CN(C)c1nc(-c2ccccc2)c(N)c(-c2ccccc2)n1.
What is the InChIKey of 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine?
The InChIKey is XGXDOILAGPABMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4/c1-22(2)18-20-16(13-9-5-3-6-10-13)15(19)17(21-18)14-11-7-4-8-12-14/h3-12H,19H2,1-2H3.
What are the key properties of 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine?
2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine has a molecular weight of 290.37 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4,6-diphenylpyrimidine-2,5-diamine is sourced from PubChem (CID 781073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).