1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine

C15H32N2 — CID 79054004

IUPAC1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
SMILESCCC1CCC(C(NC)C(C)(C)N(C)C)CC1
InChIInChI=1S/C15H32N2/c1-7-12-8-10-13(11-9-12)14(16-4)15(2,3)17(5)6/h12-14,16H,7-11H2,1-6H3
InChIKeyQOVHFJXBZPSRLP-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.13
Rot. Bonds5

About 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine

1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine (PubChem CID 79054004) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
PubChem CID79054004
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
SMILESCCC1CCC(C(NC)C(C)(C)N(C)C)CC1
InChIInChI=1S/C15H32N2/c1-7-12-8-10-13(11-9-12)14(16-4)15(2,3)17(5)6/h12-14,16H,7-11H2,1-6H3
InChIKeyQOVHFJXBZPSRLP-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
The IUPAC name of 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine (CID 79054004) is 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine.
What is the SMILES notation for 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
The canonical SMILES for 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine is CCC1CCC(C(NC)C(C)(C)N(C)C)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
The InChIKey is QOVHFJXBZPSRLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-7-12-8-10-13(11-9-12)14(16-4)15(2,3)17(5)6/h12-14,16H,7-11H2,1-6H3.
What are the key properties of 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine is sourced from PubChem (CID 79054004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).