cyclohexa-2,6-diene-1,2-diamine;ethane

C8H16N2 — CID 143733519

IUPACcyclohexa-2,6-diene-1,2-diamine;ethane
SMILESCC.NC1=CCCC=C1N
InChIInChI=1S/C6H10N2.C2H6/c7-5-3-1-2-4-6(5)8;1-2/h3-4H,1-2,7-8H2;1-2H3
InChIKeyIAMRGBUVFSNHEZ-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.49
Rot. Bonds

About cyclohexa-2,6-diene-1,2-diamine;ethane

cyclohexa-2,6-diene-1,2-diamine;ethane (PubChem CID 143733519) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is cyclohexa-2,6-diene-1,2-diamine;ethane.

Molecular Properties

Compound Namecyclohexa-2,6-diene-1,2-diamine;ethane
PubChem CID143733519
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Namecyclohexa-2,6-diene-1,2-diamine;ethane
SMILESCC.NC1=CCCC=C1N
InChIInChI=1S/C6H10N2.C2H6/c7-5-3-1-2-4-6(5)8;1-2/h3-4H,1-2,7-8H2;1-2H3
InChIKeyIAMRGBUVFSNHEZ-UHFFFAOYSA-N
XLogP1.49
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;6-methanimidoylcyclohexa-1,5-dien-1-amine
CID 144895641
5,6-dimethylcyclohexa-1,5-dien-1-amine
CID 143080216
6-methanimidoylcyclohexa-1,5-dien-1-amine
CID 142103720
ethane;5-methylcyclohexa-1,5-dien-1-amine
CID 144692983
1-methyl-2H-pyridine-4,5-diamine
CID 141045250
2-aminobenzenethiol;6-aminocyclohexa-1,5-diene-1-thiol
CID 153375850
ethane;1-methylcyclobutene
CID 91484029
2-amino-4,6-bis(2-phenylpropan-2-yl)phenol;cyclohexa-2,6-diene-1,2-diamine
CID 145365952
(2Z,6E)-2-methyl-4,5-dihydroazocin-7-amine
CID 177054530
7-amino-2-ethylcyclohepta-1,6-dien-1-ol
CID 143076637
(1Z,5Z)-1,6-dimethylcycloocta-1,5-diene
CID 5365761
7-amino-3,3-dimethylcyclohepta-1,6-diene-1-carbonitrile
CID 137427537

Frequently Asked Questions

What is the IUPAC name of cyclohexa-2,6-diene-1,2-diamine;ethane?
The IUPAC name of cyclohexa-2,6-diene-1,2-diamine;ethane (CID 143733519) is cyclohexa-2,6-diene-1,2-diamine;ethane.
What is the SMILES notation for cyclohexa-2,6-diene-1,2-diamine;ethane?
The canonical SMILES for cyclohexa-2,6-diene-1,2-diamine;ethane is CC.NC1=CCCC=C1N.
What is the InChIKey of cyclohexa-2,6-diene-1,2-diamine;ethane?
The InChIKey is IAMRGBUVFSNHEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.C2H6/c7-5-3-1-2-4-6(5)8;1-2/h3-4H,1-2,7-8H2;1-2H3.
What are the key properties of cyclohexa-2,6-diene-1,2-diamine;ethane?
cyclohexa-2,6-diene-1,2-diamine;ethane has a molecular weight of 140.23 g/mol, XLogP of 1.49, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexa-2,6-diene-1,2-diamine;ethane is sourced from PubChem (CID 143733519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).