1-(4-ethylcyclohexyl)diazinane

C12H24N2 — CID 131059592

IUPAC1-(4-ethylcyclohexyl)diazinane
SMILESCCC1CCC(N2CCCCN2)CC1
InChIInChI=1S/C12H24N2/c1-2-11-5-7-12(8-6-11)14-10-4-3-9-13-14/h11-13H,2-10H2,1H3
InChIKeyKSENZGPNGZMKHV-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.56
Rot. Bonds2

About 1-(4-ethylcyclohexyl)diazinane

1-(4-ethylcyclohexyl)diazinane (PubChem CID 131059592) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)diazinane.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)diazinane
PubChem CID131059592
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-(4-ethylcyclohexyl)diazinane
SMILESCCC1CCC(N2CCCCN2)CC1
InChIInChI=1S/C12H24N2/c1-2-11-5-7-12(8-6-11)14-10-4-3-9-13-14/h11-13H,2-10H2,1H3
InChIKeyKSENZGPNGZMKHV-UHFFFAOYSA-N
XLogP2.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)diazinane?
The IUPAC name of 1-(4-ethylcyclohexyl)diazinane (CID 131059592) is 1-(4-ethylcyclohexyl)diazinane.
What is the SMILES notation for 1-(4-ethylcyclohexyl)diazinane?
The canonical SMILES for 1-(4-ethylcyclohexyl)diazinane is CCC1CCC(N2CCCCN2)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)diazinane?
The InChIKey is KSENZGPNGZMKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-2-11-5-7-12(8-6-11)14-10-4-3-9-13-14/h11-13H,2-10H2,1H3.
What are the key properties of 1-(4-ethylcyclohexyl)diazinane?
1-(4-ethylcyclohexyl)diazinane has a molecular weight of 196.34 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)diazinane is sourced from PubChem (CID 131059592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).