2-nonyl-1,2-dihydropyridine

C14H25N — CID 134546505

IUPAC2-nonyl-1,2-dihydropyridine
SMILESCCCCCCCCCC1C=CC=CN1
InChIInChI=1S/C14H25N/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15-14/h9-10,12-15H,2-8,11H2,1H3
InChIKeySVRNZZJLBJUFPU-UHFFFAOYSA-N
MW207.36 g/mol
LogP4.17
Rot. Bonds8

About 2-nonyl-1,2-dihydropyridine

2-nonyl-1,2-dihydropyridine (PubChem CID 134546505) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 2-nonyl-1,2-dihydropyridine.

Molecular Properties

Compound Name2-nonyl-1,2-dihydropyridine
PubChem CID134546505
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name2-nonyl-1,2-dihydropyridine
SMILESCCCCCCCCCC1C=CC=CN1
InChIInChI=1S/C14H25N/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15-14/h9-10,12-15H,2-8,11H2,1H3
InChIKeySVRNZZJLBJUFPU-UHFFFAOYSA-N
XLogP4.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.17
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

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3-butyl-2-hexyl-1,2-dihydropyridine
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CID 97304116
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Frequently Asked Questions

What is the IUPAC name of 2-nonyl-1,2-dihydropyridine?
The IUPAC name of 2-nonyl-1,2-dihydropyridine (CID 134546505) is 2-nonyl-1,2-dihydropyridine.
What is the SMILES notation for 2-nonyl-1,2-dihydropyridine?
The canonical SMILES for 2-nonyl-1,2-dihydropyridine is CCCCCCCCCC1C=CC=CN1.
What is the InChIKey of 2-nonyl-1,2-dihydropyridine?
The InChIKey is SVRNZZJLBJUFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15-14/h9-10,12-15H,2-8,11H2,1H3.
What are the key properties of 2-nonyl-1,2-dihydropyridine?
2-nonyl-1,2-dihydropyridine has a molecular weight of 207.36 g/mol, XLogP of 4.17, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nonyl-1,2-dihydropyridine is sourced from PubChem (CID 134546505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).