1-cyclohexylidene-N',N'-diethylmethanediamine

C11H22N2 — CID 25249618

IUPAC1-cyclohexylidene-N',N'-diethylmethanediamine
SMILESCCN(CC)C(N)=C1CCCCC1
InChIInChI=1S/C11H22N2/c1-3-13(4-2)11(12)10-8-6-5-7-9-10/h3-9,12H2,1-2H3
InChIKeyXJGVIZDLVITZIA-UHFFFAOYSA-N
MW182.31 g/mol
LogP2.46
Rot. Bonds3

About 1-cyclohexylidene-N',N'-diethylmethanediamine

1-cyclohexylidene-N',N'-diethylmethanediamine (PubChem CID 25249618) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-cyclohexylidene-N',N'-diethylmethanediamine.

Molecular Properties

Compound Name1-cyclohexylidene-N',N'-diethylmethanediamine
PubChem CID25249618
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-cyclohexylidene-N',N'-diethylmethanediamine
SMILESCCN(CC)C(N)=C1CCCCC1
InChIInChI=1S/C11H22N2/c1-3-13(4-2)11(12)10-8-6-5-7-9-10/h3-9,12H2,1-2H3
InChIKeyXJGVIZDLVITZIA-UHFFFAOYSA-N
XLogP2.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexylidene-N',N'-diethylmethanediamine?
The IUPAC name of 1-cyclohexylidene-N',N'-diethylmethanediamine (CID 25249618) is 1-cyclohexylidene-N',N'-diethylmethanediamine.
What is the SMILES notation for 1-cyclohexylidene-N',N'-diethylmethanediamine?
The canonical SMILES for 1-cyclohexylidene-N',N'-diethylmethanediamine is CCN(CC)C(N)=C1CCCCC1.
What is the InChIKey of 1-cyclohexylidene-N',N'-diethylmethanediamine?
The InChIKey is XJGVIZDLVITZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-3-13(4-2)11(12)10-8-6-5-7-9-10/h3-9,12H2,1-2H3.
What are the key properties of 1-cyclohexylidene-N',N'-diethylmethanediamine?
1-cyclohexylidene-N',N'-diethylmethanediamine has a molecular weight of 182.31 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexylidene-N',N'-diethylmethanediamine is sourced from PubChem (CID 25249618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).