1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine

C11H18N2 — CID 141201028

IUPAC1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine
SMILESCN(C)C(=C1C=CC=CC1)N(C)C
InChIInChI=1S/C11H18N2/c1-12(2)11(13(3)4)10-8-6-5-7-9-10/h5-8H,9H2,1-4H3
InChIKeyCUFRKWLVFWCPGV-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.84
Rot. Bonds2

About 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine

1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine (PubChem CID 141201028) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine.

Molecular Properties

Compound Name1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine
PubChem CID141201028
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine
SMILESCN(C)C(=C1C=CC=CC1)N(C)C
InChIInChI=1S/C11H18N2/c1-12(2)11(13(3)4)10-8-6-5-7-9-10/h5-8H,9H2,1-4H3
InChIKeyCUFRKWLVFWCPGV-UHFFFAOYSA-N
XLogP1.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine?
The IUPAC name of 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine (CID 141201028) is 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine.
What is the SMILES notation for 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine?
The canonical SMILES for 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine is CN(C)C(=C1C=CC=CC1)N(C)C.
What is the InChIKey of 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine?
The InChIKey is CUFRKWLVFWCPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-12(2)11(13(3)4)10-8-6-5-7-9-10/h5-8H,9H2,1-4H3.
What are the key properties of 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine?
1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine has a molecular weight of 178.28 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine is sourced from PubChem (CID 141201028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).