8-methylnon-7-ene-1,6-diamine

C10H22N2 — CID 88831960

IUPAC8-methylnon-7-ene-1,6-diamine
SMILESCC(C)=CC(N)CCCCCN
InChIInChI=1S/C10H22N2/c1-9(2)8-10(12)6-4-3-5-7-11/h8,10H,3-7,11-12H2,1-2H3
InChIKeyZYACHPJCNSWHCP-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.80
Rot. Bonds6

About 8-methylnon-7-ene-1,6-diamine

8-methylnon-7-ene-1,6-diamine (PubChem CID 88831960) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 8-methylnon-7-ene-1,6-diamine.

Molecular Properties

Compound Name8-methylnon-7-ene-1,6-diamine
PubChem CID88831960
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name8-methylnon-7-ene-1,6-diamine
SMILESCC(C)=CC(N)CCCCCN
InChIInChI=1S/C10H22N2/c1-9(2)8-10(12)6-4-3-5-7-11/h8,10H,3-7,11-12H2,1-2H3
InChIKeyZYACHPJCNSWHCP-UHFFFAOYSA-N
XLogP1.80
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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CID 550746
CID 550746
CID 45791128
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CID 54562398
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CID 73433718
CID 73433718
CID 118540789
CID 118540789
CID 140142280
CID 140142280
CID 163667843
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CID 12046652
CID 12046652

Frequently Asked Questions

What is the IUPAC name of 8-methylnon-7-ene-1,6-diamine?
The IUPAC name of 8-methylnon-7-ene-1,6-diamine (CID 88831960) is 8-methylnon-7-ene-1,6-diamine.
What is the SMILES notation for 8-methylnon-7-ene-1,6-diamine?
The canonical SMILES for 8-methylnon-7-ene-1,6-diamine is CC(C)=CC(N)CCCCCN.
What is the InChIKey of 8-methylnon-7-ene-1,6-diamine?
The InChIKey is ZYACHPJCNSWHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(2)8-10(12)6-4-3-5-7-11/h8,10H,3-7,11-12H2,1-2H3.
What are the key properties of 8-methylnon-7-ene-1,6-diamine?
8-methylnon-7-ene-1,6-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylnon-7-ene-1,6-diamine is sourced from PubChem (CID 88831960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).