N,1-di(nonyl)pyridin-4-imine

C23H42N2 — CID 14198651

IUPACN,1-di(nonyl)pyridin-4-imine
SMILESCCCCCCCCCN=c1ccn(CCCCCCCCC)cc1
InChIInChI=1S/C23H42N2/c1-3-5-7-9-11-13-15-19-24-23-17-21-25(22-18-23)20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20H2,1-2H3
InChIKeyXEUMAJUAYQXBFL-UHFFFAOYSA-N
MW346.60 g/mol
LogP6.89
Rot. Bonds16

About N,1-di(nonyl)pyridin-4-imine

N,1-di(nonyl)pyridin-4-imine (PubChem CID 14198651) has the molecular formula C23H42N2 and a molecular weight of 346.60 g/mol. Its IUPAC name is N,1-di(nonyl)pyridin-4-imine.

Molecular Properties

Compound NameN,1-di(nonyl)pyridin-4-imine
PubChem CID14198651
Molecular FormulaC23H42N2
Molecular Weight346.60 g/mol
Exact Mass346.33
IUPAC NameN,1-di(nonyl)pyridin-4-imine
SMILESCCCCCCCCCN=c1ccn(CCCCCCCCC)cc1
InChIInChI=1S/C23H42N2/c1-3-5-7-9-11-13-15-19-24-23-17-21-25(22-18-23)20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20H2,1-2H3
InChIKeyXEUMAJUAYQXBFL-UHFFFAOYSA-N
XLogP6.89
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.60
LogP ≤ 56.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-decyl-1-[12-(4-decylimino-1-pyridinyl)dodecyl]pyridin-4-imine
CID 13408540
N-heptyl-1-[4-(4-heptylimino-1-pyridinyl)butyl]pyridin-4-imine
CID 13408472
N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine dichloride
CID 170923435
methane;N-octyl-1-[10-[4-(octylamino)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-amine;N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine
CID 160679501
1-[10-(4-imino-6-octyl-2,3-dihydropyridin-1-yl)decyl]-N-octylpyridin-4-imine
CID 123992192
1-decylpyridin-4-imine
CID 534503
1-heptadecylpyrrole
CID 23344128
1-docosylpyrrole
CID 23344131
2-[6-[[amino-[[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine;bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid);dihydrochloride
CID 173305876
1-pentylpyrrole;propane
CID 174972146
1-(1-octylpyrrol-3-yl)propan-1-amine
CID 79105838
(1-heptylpyrrol-3-yl)methanol
CID 66399953

Frequently Asked Questions

What is the IUPAC name of N,1-di(nonyl)pyridin-4-imine?
The IUPAC name of N,1-di(nonyl)pyridin-4-imine (CID 14198651) is N,1-di(nonyl)pyridin-4-imine.
What is the SMILES notation for N,1-di(nonyl)pyridin-4-imine?
The canonical SMILES for N,1-di(nonyl)pyridin-4-imine is CCCCCCCCCN=c1ccn(CCCCCCCCC)cc1.
What is the InChIKey of N,1-di(nonyl)pyridin-4-imine?
The InChIKey is XEUMAJUAYQXBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H42N2/c1-3-5-7-9-11-13-15-19-24-23-17-21-25(22-18-23)20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20H2,1-2H3.
What are the key properties of N,1-di(nonyl)pyridin-4-imine?
N,1-di(nonyl)pyridin-4-imine has a molecular weight of 346.60 g/mol, XLogP of 6.89, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-di(nonyl)pyridin-4-imine is sourced from PubChem (CID 14198651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).