N,N-dipentyl-1,3,5-triazin-2-amine

C13H24N4 — CID 22446555

IUPACN,N-dipentyl-1,3,5-triazin-2-amine
SMILESCCCCCN(CCCCC)c1ncncn1
InChIInChI=1S/C13H24N4/c1-3-5-7-9-17(10-8-6-4-2)13-15-11-14-12-16-13/h11-12H,3-10H2,1-2H3
InChIKeyLQYKQHWCXFBSNC-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.06
Rot. Bonds9

About N,N-dipentyl-1,3,5-triazin-2-amine

N,N-dipentyl-1,3,5-triazin-2-amine (PubChem CID 22446555) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N,N-dipentyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN,N-dipentyl-1,3,5-triazin-2-amine
PubChem CID22446555
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN,N-dipentyl-1,3,5-triazin-2-amine
SMILESCCCCCN(CCCCC)c1ncncn1
InChIInChI=1S/C13H24N4/c1-3-5-7-9-17(10-8-6-4-2)13-15-11-14-12-16-13/h11-12H,3-10H2,1-2H3
InChIKeyLQYKQHWCXFBSNC-UHFFFAOYSA-N
XLogP3.06
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dipentyl-1,3,5-triazin-2-amine?
The IUPAC name of N,N-dipentyl-1,3,5-triazin-2-amine (CID 22446555) is N,N-dipentyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N,N-dipentyl-1,3,5-triazin-2-amine?
The canonical SMILES for N,N-dipentyl-1,3,5-triazin-2-amine is CCCCCN(CCCCC)c1ncncn1.
What is the InChIKey of N,N-dipentyl-1,3,5-triazin-2-amine?
The InChIKey is LQYKQHWCXFBSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-3-5-7-9-17(10-8-6-4-2)13-15-11-14-12-16-13/h11-12H,3-10H2,1-2H3.
What are the key properties of N,N-dipentyl-1,3,5-triazin-2-amine?
N,N-dipentyl-1,3,5-triazin-2-amine has a molecular weight of 236.36 g/mol, XLogP of 3.06, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipentyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 22446555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).