N-methyl-2,6-diphenylpyrimidin-4-amine

C17H15N3 — CID 4713922

IUPACN-methyl-2,6-diphenylpyrimidin-4-amine
SMILESCNc1cc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C17H15N3/c1-18-16-12-15(13-8-4-2-5-9-13)19-17(20-16)14-10-6-3-7-11-14/h2-12H,1H3,(H,18,19,20)
InChIKeyMRCDLNBTHBLDBX-UHFFFAOYSA-N
MW261.33 g/mol
LogP3.85
Rot. Bonds3

About N-methyl-2,6-diphenylpyrimidin-4-amine

N-methyl-2,6-diphenylpyrimidin-4-amine (PubChem CID 4713922) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is N-methyl-2,6-diphenylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-2,6-diphenylpyrimidin-4-amine
PubChem CID4713922
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC NameN-methyl-2,6-diphenylpyrimidin-4-amine
SMILESCNc1cc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C17H15N3/c1-18-16-12-15(13-8-4-2-5-9-13)19-17(20-16)14-10-6-3-7-11-14/h2-12H,1H3,(H,18,19,20)
InChIKeyMRCDLNBTHBLDBX-UHFFFAOYSA-N
XLogP3.85
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2,6-diphenylpyrimidin-4-amine?
The IUPAC name of N-methyl-2,6-diphenylpyrimidin-4-amine (CID 4713922) is N-methyl-2,6-diphenylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-2,6-diphenylpyrimidin-4-amine?
The canonical SMILES for N-methyl-2,6-diphenylpyrimidin-4-amine is CNc1cc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of N-methyl-2,6-diphenylpyrimidin-4-amine?
The InChIKey is MRCDLNBTHBLDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-18-16-12-15(13-8-4-2-5-9-13)19-17(20-16)14-10-6-3-7-11-14/h2-12H,1H3,(H,18,19,20).
What are the key properties of N-methyl-2,6-diphenylpyrimidin-4-amine?
N-methyl-2,6-diphenylpyrimidin-4-amine has a molecular weight of 261.33 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2,6-diphenylpyrimidin-4-amine is sourced from PubChem (CID 4713922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).