1-(1,3,5-triazin-2-yl)ethene-1,2-diamine

C5H7N5 — CID 67643771

IUPAC1-(1,3,5-triazin-2-yl)ethene-1,2-diamine
SMILESNC=C(N)c1ncncn1
InChIInChI=1S/C5H7N5/c6-1-4(7)5-9-2-8-3-10-5/h1-3H,6-7H2
InChIKeyJWTHNVSYSCUHIX-UHFFFAOYSA-N
MW137.15 g/mol
LogP-0.91
Rot. Bonds1

About 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine

1-(1,3,5-triazin-2-yl)ethene-1,2-diamine (PubChem CID 67643771) has the molecular formula C5H7N5 and a molecular weight of 137.15 g/mol. Its IUPAC name is 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine.

Molecular Properties

Compound Name1-(1,3,5-triazin-2-yl)ethene-1,2-diamine
PubChem CID67643771
Molecular FormulaC5H7N5
Molecular Weight137.15 g/mol
Exact Mass137.07
IUPAC Name1-(1,3,5-triazin-2-yl)ethene-1,2-diamine
SMILESNC=C(N)c1ncncn1
InChIInChI=1S/C5H7N5/c6-1-4(7)5-9-2-8-3-10-5/h1-3H,6-7H2
InChIKeyJWTHNVSYSCUHIX-UHFFFAOYSA-N
XLogP-0.91
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.15
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine?
The IUPAC name of 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine (CID 67643771) is 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine.
What is the SMILES notation for 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine?
The canonical SMILES for 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine is NC=C(N)c1ncncn1.
What is the InChIKey of 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine?
The InChIKey is JWTHNVSYSCUHIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N5/c6-1-4(7)5-9-2-8-3-10-5/h1-3H,6-7H2.
What are the key properties of 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine?
1-(1,3,5-triazin-2-yl)ethene-1,2-diamine has a molecular weight of 137.15 g/mol, XLogP of -0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3,5-triazin-2-yl)ethene-1,2-diamine is sourced from PubChem (CID 67643771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).