2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine

C15H20N4 — CID 62192827

IUPAC2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine
SMILESCCN(CC)c1nc(NC)cc(-c2ccccc2)n1
InChIInChI=1S/C15H20N4/c1-4-19(5-2)15-17-13(11-14(16-3)18-15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyFLBMGFFWLCWHPK-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.03
Rot. Bonds5

About 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine

2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine (PubChem CID 62192827) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine
PubChem CID62192827
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine
SMILESCCN(CC)c1nc(NC)cc(-c2ccccc2)n1
InChIInChI=1S/C15H20N4/c1-4-19(5-2)15-17-13(11-14(16-3)18-15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyFLBMGFFWLCWHPK-UHFFFAOYSA-N
XLogP3.03
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.03
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-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine?
The IUPAC name of 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine (CID 62192827) is 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine?
The canonical SMILES for 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine is CCN(CC)c1nc(NC)cc(-c2ccccc2)n1.
What is the InChIKey of 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine?
The InChIKey is FLBMGFFWLCWHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-4-19(5-2)15-17-13(11-14(16-3)18-15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3,(H,16,17,18).
What are the key properties of 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine?
2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine has a molecular weight of 256.35 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine is sourced from PubChem (CID 62192827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).