5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine

C17H16N4 — CID 10214732

IUPAC5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine
SMILESNCc1c(N)nc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C17H16N4/c18-11-14-15(12-7-3-1-4-8-12)20-17(21-16(14)19)13-9-5-2-6-10-13/h1-10H,11,18H2,(H2,19,20,21)
InChIKeyDJTMODWGQGJJLB-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.85
Rot. Bonds3

About 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine

5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine (PubChem CID 10214732) has the molecular formula C17H16N4 and a molecular weight of 276.34 g/mol. Its IUPAC name is 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine.

Molecular Properties

Compound Name5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine
PubChem CID10214732
Molecular FormulaC17H16N4
Molecular Weight276.34 g/mol
Exact Mass276.14
IUPAC Name5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine
SMILESNCc1c(N)nc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C17H16N4/c18-11-14-15(12-7-3-1-4-8-12)20-17(21-16(14)19)13-9-5-2-6-10-13/h1-10H,11,18H2,(H2,19,20,21)
InChIKeyDJTMODWGQGJJLB-UHFFFAOYSA-N
XLogP2.85
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Diamino-5-phenyl-6-ethylpyrimidine, 2,4-
CID 93114
4,6-Diphenylpyrimidin-2-amine
CID 619024
N2,N4-Dibenzylquinazoline-2,4-diamine
CID 676352
N-Benzyl-2-phenyl-4-quinazolinamine
CID 780643
2-Chloro-4,6-diphenylpyrimidine
CID 1804739
4-Bromo-2,6-diphenylpyrimidine
CID 817533
4-Chloro-2,6-diphenylpyrimidine
CID 582041
5-Phenyl-6-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 9814965
2,4-Pyrimidinediamine, 6-hexyl-5-phenyl-
CID 9881905
5-(3-Chlorophenyl)-6-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 9974420
5-(Aminomethyl)-6-(2,4-dichlorophenyl)-2-(4-fluorophenyl)pyrimidin-4-amine
CID 10126186
5-(Aminomethyl)-6-(2,4-dichlorophenyl)-2-(3-methylphenyl)pyrimidin-4-amine
CID 10172375

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine?
The IUPAC name of 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine (CID 10214732) is 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine.
What is the SMILES notation for 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine?
The canonical SMILES for 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine is NCc1c(N)nc(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine?
The InChIKey is DJTMODWGQGJJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4/c18-11-14-15(12-7-3-1-4-8-12)20-17(21-16(14)19)13-9-5-2-6-10-13/h1-10H,11,18H2,(H2,19,20,21).
What are the key properties of 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine?
5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine has a molecular weight of 276.34 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-2,6-diphenylpyrimidin-4-amine is sourced from PubChem (CID 10214732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).