4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine

C12H20N4 — CID 65400793

IUPAC4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine
SMILESCCCC1CCC(c2ncnc(N)n2)CC1
InChIInChI=1S/C12H20N4/c1-2-3-9-4-6-10(7-5-9)11-14-8-15-12(13)16-11/h8-10H,2-7H2,1H3,(H2,13,14,15,16)
InChIKeyOSSFXJUYHLVCRG-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.53
Rot. Bonds3

About 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine

4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine (PubChem CID 65400793) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine
PubChem CID65400793
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine
SMILESCCCC1CCC(c2ncnc(N)n2)CC1
InChIInChI=1S/C12H20N4/c1-2-3-9-4-6-10(7-5-9)11-14-8-15-12(13)16-11/h8-10H,2-7H2,1H3,(H2,13,14,15,16)
InChIKeyOSSFXJUYHLVCRG-UHFFFAOYSA-N
XLogP2.53
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine (CID 65400793) is 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine is CCCC1CCC(c2ncnc(N)n2)CC1.
What is the InChIKey of 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine?
The InChIKey is OSSFXJUYHLVCRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-2-3-9-4-6-10(7-5-9)11-14-8-15-12(13)16-11/h8-10H,2-7H2,1H3,(H2,13,14,15,16).
What are the key properties of 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine?
4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 65400793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).