4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine

Name: 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₇H₂₂N₄ — CID 63867001

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine

SMILESCc1cc(C)cc(Cc2nc(N)nc(C3CCCC3)n2)c1

InChIInChI=1S/C17H22N4/c1-11-7-12(2)9-13(8-11)10-15-19-16(21-17(18)20-15)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,18,19,20,21)

InChIKeyBGFJKSQGVDMQGK-UHFFFAOYSA-N

MW282.39 g/mol

LogP3.32

Rot. Bonds3

About 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine

4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine (PubChem CID 63867001) has the molecular formula C₁₇H₂₂N₄ and a molecular weight of 282.39 g/mol. Its IUPAC name is 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name	4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine
PubChem CID	63867001
Molecular Formula	C₁₇H₂₂N₄
Molecular Weight	282.39 g/mol
Exact Mass	282.18
IUPAC Name	4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine
SMILES	Cc1cc(C)cc(Cc2nc(N)nc(C3CCCC3)n2)c1
InChI	InChI=1S/C17H22N4/c1-11-7-12(2)9-13(8-11)10-15-19-16(21-17(18)20-15)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,18,19,20,21)
InChIKey	BGFJKSQGVDMQGK-UHFFFAOYSA-N
XLogP	3.32
TPSA	64.69 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	3
Heavy Atoms	21
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	282.39
LogP ≤ 5	3.32
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?

The IUPAC name of 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine (CID 63867001) is 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine.

What is the SMILES notation for 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?

The canonical SMILES for 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine is Cc1cc(C)cc(Cc2nc(N)nc(C3CCCC3)n2)c1.

What is the InChIKey of 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?

The InChIKey is BGFJKSQGVDMQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-11-7-12(2)9-13(8-11)10-15-19-16(21-17(18)20-15)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,18,19,20,21).

What are the key properties of 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?

4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine has a molecular weight of 282.39 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-cyclopentyl-6-[(3,5-dimethylphenyl)methyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 63867001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 63867001 — identifiers, structure, computed properties (public domain)

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