1-N,4-N-dimethylcyclohexene-1,4-diamine

C8H16N2 — CID 89097069

IUPAC1-N,4-N-dimethylcyclohexene-1,4-diamine
SMILESCNC1=CCC(NC)CC1
InChIInChI=1S/C8H16N2/c1-9-7-3-5-8(10-2)6-4-7/h3,8-10H,4-6H2,1-2H3
InChIKeyYVHNBMHNIWYOMJ-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.86
Rot. Bonds2

About 1-N,4-N-dimethylcyclohexene-1,4-diamine

1-N,4-N-dimethylcyclohexene-1,4-diamine (PubChem CID 89097069) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-N,4-N-dimethylcyclohexene-1,4-diamine.

Molecular Properties

Compound Name1-N,4-N-dimethylcyclohexene-1,4-diamine
PubChem CID89097069
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-N,4-N-dimethylcyclohexene-1,4-diamine
SMILESCNC1=CCC(NC)CC1
InChIInChI=1S/C8H16N2/c1-9-7-3-5-8(10-2)6-4-7/h3,8-10H,4-6H2,1-2H3
InChIKeyYVHNBMHNIWYOMJ-UHFFFAOYSA-N
XLogP0.86
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-dimethylcyclohexene-1,4-diamine?
The IUPAC name of 1-N,4-N-dimethylcyclohexene-1,4-diamine (CID 89097069) is 1-N,4-N-dimethylcyclohexene-1,4-diamine.
What is the SMILES notation for 1-N,4-N-dimethylcyclohexene-1,4-diamine?
The canonical SMILES for 1-N,4-N-dimethylcyclohexene-1,4-diamine is CNC1=CCC(NC)CC1.
What is the InChIKey of 1-N,4-N-dimethylcyclohexene-1,4-diamine?
The InChIKey is YVHNBMHNIWYOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-9-7-3-5-8(10-2)6-4-7/h3,8-10H,4-6H2,1-2H3.
What are the key properties of 1-N,4-N-dimethylcyclohexene-1,4-diamine?
1-N,4-N-dimethylcyclohexene-1,4-diamine has a molecular weight of 140.23 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-dimethylcyclohexene-1,4-diamine is sourced from PubChem (CID 89097069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).