6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine

C13H23N5 — CID 55251716

IUPAC6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(C2CCCCC2)n1
InChIInChI=1S/C13H23N5/c1-3-18(4-2)13-16-11(15-12(14)17-13)10-8-6-5-7-9-10/h10H,3-9H2,1-2H3,(H2,14,15,16,17)
InChIKeyWUMWARGDWMLPOC-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.35
Rot. Bonds4

About 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine

6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine (PubChem CID 55251716) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine
PubChem CID55251716
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC Name6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(C2CCCCC2)n1
InChIInChI=1S/C13H23N5/c1-3-18(4-2)13-16-11(15-12(14)17-13)10-8-6-5-7-9-10/h10H,3-9H2,1-2H3,(H2,14,15,16,17)
InChIKeyWUMWARGDWMLPOC-UHFFFAOYSA-N
XLogP2.35
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine (CID 55251716) is 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine is CCN(CC)c1nc(N)nc(C2CCCCC2)n1.
What is the InChIKey of 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is WUMWARGDWMLPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-3-18(4-2)13-16-11(15-12(14)17-13)10-8-6-5-7-9-10/h10H,3-9H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine?
6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 249.36 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-2-N,2-N-diethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 55251716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).