N,7-dimethylnon-5-en-1-amine

C11H23N — CID 166916633

IUPACN,7-dimethylnon-5-en-1-amine
SMILESCCC(C)C=CCCCCNC
InChIInChI=1S/C11H23N/c1-4-11(2)9-7-5-6-8-10-12-3/h7,9,11-12H,4-6,8,10H2,1-3H3
InChIKeyCSIGQBGPDORONA-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.98
Rot. Bonds7

About N,7-dimethylnon-5-en-1-amine

N,7-dimethylnon-5-en-1-amine (PubChem CID 166916633) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N,7-dimethylnon-5-en-1-amine.

Molecular Properties

Compound NameN,7-dimethylnon-5-en-1-amine
PubChem CID166916633
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN,7-dimethylnon-5-en-1-amine
SMILESCCC(C)C=CCCCCNC
InChIInChI=1S/C11H23N/c1-4-11(2)9-7-5-6-8-10-12-3/h7,9,11-12H,4-6,8,10H2,1-3H3
InChIKeyCSIGQBGPDORONA-UHFFFAOYSA-N
XLogP2.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 N,7-dimethylnon-5-en-1-amine?
The IUPAC name of N,7-dimethylnon-5-en-1-amine (CID 166916633) is N,7-dimethylnon-5-en-1-amine.
What is the SMILES notation for N,7-dimethylnon-5-en-1-amine?
The canonical SMILES for N,7-dimethylnon-5-en-1-amine is CCC(C)C=CCCCCNC.
What is the InChIKey of N,7-dimethylnon-5-en-1-amine?
The InChIKey is CSIGQBGPDORONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-4-11(2)9-7-5-6-8-10-12-3/h7,9,11-12H,4-6,8,10H2,1-3H3.
What are the key properties of N,7-dimethylnon-5-en-1-amine?
N,7-dimethylnon-5-en-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-dimethylnon-5-en-1-amine is sourced from PubChem (CID 166916633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).