6-methylnon-7-ene-1,5-diamine

C10H22N2 — CID 130322819

IUPAC6-methylnon-7-ene-1,5-diamine
SMILESCC=CC(C)C(N)CCCCN
InChIInChI=1S/C10H22N2/c1-3-6-9(2)10(12)7-4-5-8-11/h3,6,9-10H,4-5,7-8,11-12H2,1-2H3
InChIKeyFALLXNMMLCMWID-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.65
Rot. Bonds6

About 6-methylnon-7-ene-1,5-diamine

6-methylnon-7-ene-1,5-diamine (PubChem CID 130322819) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 6-methylnon-7-ene-1,5-diamine.

Molecular Properties

Compound Name6-methylnon-7-ene-1,5-diamine
PubChem CID130322819
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name6-methylnon-7-ene-1,5-diamine
SMILESCC=CC(C)C(N)CCCCN
InChIInChI=1S/C10H22N2/c1-3-6-9(2)10(12)7-4-5-8-11/h3,6,9-10H,4-5,7-8,11-12H2,1-2H3
InChIKeyFALLXNMMLCMWID-UHFFFAOYSA-N
XLogP1.65
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 ≤ 51.65
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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Frequently Asked Questions

What is the IUPAC name of 6-methylnon-7-ene-1,5-diamine?
The IUPAC name of 6-methylnon-7-ene-1,5-diamine (CID 130322819) is 6-methylnon-7-ene-1,5-diamine.
What is the SMILES notation for 6-methylnon-7-ene-1,5-diamine?
The canonical SMILES for 6-methylnon-7-ene-1,5-diamine is CC=CC(C)C(N)CCCCN.
What is the InChIKey of 6-methylnon-7-ene-1,5-diamine?
The InChIKey is FALLXNMMLCMWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-6-9(2)10(12)7-4-5-8-11/h3,6,9-10H,4-5,7-8,11-12H2,1-2H3.
What are the key properties of 6-methylnon-7-ene-1,5-diamine?
6-methylnon-7-ene-1,5-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.65, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylnon-7-ene-1,5-diamine is sourced from PubChem (CID 130322819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).