2-N-phenyl-1,3,5-triazine-2,4-diamine

C9H9N5 — CID 10832

💊View drug profile → amanozine
IUPAC2-N-phenyl-1,3,5-triazine-2,4-diamine
SMILESNc1ncnc(Nc2ccccc2)n1
InChIInChI=1S/C9H9N5/c10-8-11-6-12-9(14-8)13-7-4-2-1-3-5-7/h1-6H,(H3,10,11,12,13,14)
InChIKeyYMFGJWGABDOFID-UHFFFAOYSA-N
MW187.21 g/mol
LogP1.20
Rot. Bonds2

About 2-N-phenyl-1,3,5-triazine-2,4-diamine

2-N-phenyl-1,3,5-triazine-2,4-diamine (PubChem CID 10832) has the molecular formula C9H9N5 and a molecular weight of 187.21 g/mol. Its IUPAC name is 2-N-phenyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-phenyl-1,3,5-triazine-2,4-diamine
PubChem CID10832
Molecular FormulaC9H9N5
Molecular Weight187.21 g/mol
Exact Mass187.09
IUPAC Name2-N-phenyl-1,3,5-triazine-2,4-diamine
SMILESNc1ncnc(Nc2ccccc2)n1
InChIInChI=1S/C9H9N5/c10-8-11-6-12-9(14-8)13-7-4-2-1-3-5-7/h1-6H,(H3,10,11,12,13,14)
InChIKeyYMFGJWGABDOFID-UHFFFAOYSA-N
XLogP1.20
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Chlorazanil
CID 10374
Melarsen oxide
CID 30830
1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-diphenyl-
CID 16088
2-N-(3-(trifluoromethyl)phenyl)-1,3,5-triazine-2,4-diamine
CID 704906
N-Phenyl-6-trifluoromethyl-[1,3,5]triazine-2,4-diamine
CID 9714
Triphenylmelamine
CID 16084
N-(2-Chlorophenyl)-1,3,5-triazine-2,4-diamine
CID 2730248
2-N-(3-fluorophenyl)-1,3,5-triazine-2,4-diamine
CID 2737693
4,6-dimethoxy-N-phenyl-1,3,5-triazin-2-amine
CID 35020
N-tert-Butyl-6-chloro-N'-phenyl-[1,3,5]triazine-2,4-diamine
CID 744423
6-Chloro-N-isopropyl-N'-phenyl-[1,3,5]triazine-2,4-diamine
CID 790766
6-chloro-4-N-methyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 840843

Frequently Asked Questions

What is the IUPAC name of 2-N-phenyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-phenyl-1,3,5-triazine-2,4-diamine (CID 10832) is 2-N-phenyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-phenyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-phenyl-1,3,5-triazine-2,4-diamine is Nc1ncnc(Nc2ccccc2)n1.
What is the InChIKey of 2-N-phenyl-1,3,5-triazine-2,4-diamine?
The InChIKey is YMFGJWGABDOFID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5/c10-8-11-6-12-9(14-8)13-7-4-2-1-3-5-7/h1-6H,(H3,10,11,12,13,14).
What are the key properties of 2-N-phenyl-1,3,5-triazine-2,4-diamine?
2-N-phenyl-1,3,5-triazine-2,4-diamine has a molecular weight of 187.21 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-phenyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 10832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).