4-propyl-1,3,5-triazin-2-amine

C6H10N4 — CID 63868846

IUPAC4-propyl-1,3,5-triazin-2-amine
SMILESCCCc1ncnc(N)n1
InChIInChI=1S/C6H10N4/c1-2-3-5-8-4-9-6(7)10-5/h4H,2-3H2,1H3,(H2,7,8,9,10)
InChIKeyPWCRCJMYDQRDNC-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.41
Rot. Bonds2

About 4-propyl-1,3,5-triazin-2-amine

4-propyl-1,3,5-triazin-2-amine (PubChem CID 63868846) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 4-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-propyl-1,3,5-triazin-2-amine
PubChem CID63868846
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name4-propyl-1,3,5-triazin-2-amine
SMILESCCCc1ncnc(N)n1
InChIInChI=1S/C6H10N4/c1-2-3-5-8-4-9-6(7)10-5/h4H,2-3H2,1H3,(H2,7,8,9,10)
InChIKeyPWCRCJMYDQRDNC-UHFFFAOYSA-N
XLogP0.41
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-propyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-propyl-1,3,5-triazin-2-amine (CID 63868846) is 4-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-propyl-1,3,5-triazin-2-amine is CCCc1ncnc(N)n1.
What is the InChIKey of 4-propyl-1,3,5-triazin-2-amine?
The InChIKey is PWCRCJMYDQRDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c1-2-3-5-8-4-9-6(7)10-5/h4H,2-3H2,1H3,(H2,7,8,9,10).
What are the key properties of 4-propyl-1,3,5-triazin-2-amine?
4-propyl-1,3,5-triazin-2-amine has a molecular weight of 138.17 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63868846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).