5-nonyl-1,2,3,4-tetrahydroquinoline

C18H29N — CID 106778340

IUPAC5-nonyl-1,2,3,4-tetrahydroquinoline
SMILESCCCCCCCCCc1cccc2c1CCCN2
InChIInChI=1S/C18H29N/c1-2-3-4-5-6-7-8-11-16-12-9-14-18-17(16)13-10-15-19-18/h9,12,14,19H,2-8,10-11,13,15H2,1H3
InChIKeyZIASNLTUSWPFPK-UHFFFAOYSA-N
MW259.44 g/mol
LogP5.34
Rot. Bonds8

About 5-nonyl-1,2,3,4-tetrahydroquinoline

5-nonyl-1,2,3,4-tetrahydroquinoline (PubChem CID 106778340) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 5-nonyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name5-nonyl-1,2,3,4-tetrahydroquinoline
PubChem CID106778340
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name5-nonyl-1,2,3,4-tetrahydroquinoline
SMILESCCCCCCCCCc1cccc2c1CCCN2
InChIInChI=1S/C18H29N/c1-2-3-4-5-6-7-8-11-16-12-9-14-18-17(16)13-10-15-19-18/h9,12,14,19H,2-8,10-11,13,15H2,1H3
InChIKeyZIASNLTUSWPFPK-UHFFFAOYSA-N
XLogP5.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.44
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Nomifensine
CID 4528
N-ethyl-3-methylaniline
CID 7603
N-1-Naphthylethylenediamine dihydrochloride
CID 15106
6-Methyl-1,2,3,4-tetrahydroquinoline
CID 66678
N-(1-Naphthyl)ethylenediamine
CID 15107
Acridan
CID 7106
N-(1-ethylpropyl)-3,4-dimethylaniline
CID 91984
1-(1-Naphthyl)piperazine
CID 1342
N-Ethyl-1-naphthalenamine
CID 67043
1,2,3,4-Tetrahydroquinoline
CID 69460
2-Mepp
CID 91965
1-(1-Naphthyl)piperazine hydrochloride
CID 2737391

Frequently Asked Questions

What is the IUPAC name of 5-nonyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 5-nonyl-1,2,3,4-tetrahydroquinoline (CID 106778340) is 5-nonyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 5-nonyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 5-nonyl-1,2,3,4-tetrahydroquinoline is CCCCCCCCCc1cccc2c1CCCN2.
What is the InChIKey of 5-nonyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is ZIASNLTUSWPFPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-2-3-4-5-6-7-8-11-16-12-9-14-18-17(16)13-10-15-19-18/h9,12,14,19H,2-8,10-11,13,15H2,1H3.
What are the key properties of 5-nonyl-1,2,3,4-tetrahydroquinoline?
5-nonyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 259.44 g/mol, XLogP of 5.34, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-nonyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 106778340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).