N,N-dibenzyl-4-methylpyrimidin-2-amine

C19H19N3 — CID 66545602

IUPACN,N-dibenzyl-4-methylpyrimidin-2-amine
SMILESCc1ccnc(N(Cc2ccccc2)Cc2ccccc2)n1
InChIInChI=1S/C19H19N3/c1-16-12-13-20-19(21-16)22(14-17-8-4-2-5-9-17)15-18-10-6-3-7-11-18/h2-13H,14-15H2,1H3
InChIKeyVLVMJPZTKRJONA-UHFFFAOYSA-N
MW289.38 g/mol
LogP3.99
Rot. Bonds5

About N,N-dibenzyl-4-methylpyrimidin-2-amine

N,N-dibenzyl-4-methylpyrimidin-2-amine (PubChem CID 66545602) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is N,N-dibenzyl-4-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN,N-dibenzyl-4-methylpyrimidin-2-amine
PubChem CID66545602
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC NameN,N-dibenzyl-4-methylpyrimidin-2-amine
SMILESCc1ccnc(N(Cc2ccccc2)Cc2ccccc2)n1
InChIInChI=1S/C19H19N3/c1-16-12-13-20-19(21-16)22(14-17-8-4-2-5-9-17)15-18-10-6-3-7-11-18/h2-13H,14-15H2,1H3
InChIKeyVLVMJPZTKRJONA-UHFFFAOYSA-N
XLogP3.99
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[benzyl-(4-methylpyrimidin-2-yl)amino]butan-1-ol
CID 133445857
4-methyl-N,N-bis(sulfanyl)pyrimidin-2-amine
CID 89307492
2-benzyl-4-methylpyrimidine;ethane
CID 142020673
N-benzyl-N,4,6-trimethylpyrimidin-2-amine
CID 734467
N-benzyl-N-ethyl-4-piperidin-1-ylpyrimidin-2-amine
CID 112884459
2-N-benzyl-2-N-ethyl-4-N-[(2-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112889696
2-N-benzyl-4-N-cyclopropyl-2-N-ethylpyrimidine-2,4-diamine
CID 112882242
2-N-benzyl-4-N-butyl-2-N-ethylpyrimidine-2,4-diamine
CID 112882826
2-[[4-(aminomethyl)pyrimidin-2-yl]-benzylamino]ethanol
CID 107541913
N-[(3-aminophenyl)methyl]-N,4-dimethylpyrimidin-2-amine
CID 55154379
N-benzyl-N-ethyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112893045
2-[benzyl(ethyl)amino]pyrimidine-4-carboximidamide
CID 107550123

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-4-methylpyrimidin-2-amine?
The IUPAC name of N,N-dibenzyl-4-methylpyrimidin-2-amine (CID 66545602) is N,N-dibenzyl-4-methylpyrimidin-2-amine.
What is the SMILES notation for N,N-dibenzyl-4-methylpyrimidin-2-amine?
The canonical SMILES for N,N-dibenzyl-4-methylpyrimidin-2-amine is Cc1ccnc(N(Cc2ccccc2)Cc2ccccc2)n1.
What is the InChIKey of N,N-dibenzyl-4-methylpyrimidin-2-amine?
The InChIKey is VLVMJPZTKRJONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-16-12-13-20-19(21-16)22(14-17-8-4-2-5-9-17)15-18-10-6-3-7-11-18/h2-13H,14-15H2,1H3.
What are the key properties of N,N-dibenzyl-4-methylpyrimidin-2-amine?
N,N-dibenzyl-4-methylpyrimidin-2-amine has a molecular weight of 289.38 g/mol, XLogP of 3.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-4-methylpyrimidin-2-amine is sourced from PubChem (CID 66545602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).