4-propan-2-yl-1,3,5-triazin-2-amine

C6H10N4 — CID 21138957

IUPAC4-propan-2-yl-1,3,5-triazin-2-amine
SMILESCC(C)c1ncnc(N)n1
InChIInChI=1S/C6H10N4/c1-4(2)5-8-3-9-6(7)10-5/h3-4H,1-2H3,(H2,7,8,9,10)
InChIKeyBPWXXFJJNYOGEV-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.58
Rot. Bonds1

About 4-propan-2-yl-1,3,5-triazin-2-amine

4-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 21138957) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 4-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID21138957
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name4-propan-2-yl-1,3,5-triazin-2-amine
SMILESCC(C)c1ncnc(N)n1
InChIInChI=1S/C6H10N4/c1-4(2)5-8-3-9-6(7)10-5/h3-4H,1-2H3,(H2,7,8,9,10)
InChIKeyBPWXXFJJNYOGEV-UHFFFAOYSA-N
XLogP0.58
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-propan-2-yl-1,3,5-triazin-2-amine (CID 21138957) is 4-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-propan-2-yl-1,3,5-triazin-2-amine is CC(C)c1ncnc(N)n1.
What is the InChIKey of 4-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is BPWXXFJJNYOGEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c1-4(2)5-8-3-9-6(7)10-5/h3-4H,1-2H3,(H2,7,8,9,10).
What are the key properties of 4-propan-2-yl-1,3,5-triazin-2-amine?
4-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 138.17 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 21138957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).