4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine

C16H20N4 — CID 63867893

IUPAC4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine
SMILESCCCc1nc(N)nc(C2(c3ccccc3)CCC2)n1
InChIInChI=1S/C16H20N4/c1-2-7-13-18-14(20-15(17)19-13)16(10-6-11-16)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H2,17,18,19,20)
InChIKeyNGSPYGGNEZGYHJ-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.88
Rot. Bonds4

About 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine

4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine (PubChem CID 63867893) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine
PubChem CID63867893
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine
SMILESCCCc1nc(N)nc(C2(c3ccccc3)CCC2)n1
InChIInChI=1S/C16H20N4/c1-2-7-13-18-14(20-15(17)19-13)16(10-6-11-16)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H2,17,18,19,20)
InChIKeyNGSPYGGNEZGYHJ-UHFFFAOYSA-N
XLogP2.88
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine (CID 63867893) is 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine is CCCc1nc(N)nc(C2(c3ccccc3)CCC2)n1.
What is the InChIKey of 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine?
The InChIKey is NGSPYGGNEZGYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-2-7-13-18-14(20-15(17)19-13)16(10-6-11-16)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H2,17,18,19,20).
What are the key properties of 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine?
4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine has a molecular weight of 268.36 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-phenylcyclobutyl)-6-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63867893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).