1-pentylpyridin-4-imine;hydroiodide

C10H17IN2 — CID 6603239

IUPAC1-pentylpyridin-4-imine;hydroiodide
SMILESI.[H]N=c1ccn(CCCCC)cc1
InChIInChI=1S/C10H16N2.HI/c1-2-3-4-7-12-8-5-10(11)6-9-12;/h5-6,8-9,11H,2-4,7H2,1H3;1H
InChIKeyNQUBFIZJIXNMEI-UHFFFAOYSA-N
MW292.16 g/mol
LogP2.78
Rot. Bonds4

About 1-pentylpyridin-4-imine;hydroiodide

1-pentylpyridin-4-imine;hydroiodide (PubChem CID 6603239) has the molecular formula C10H17IN2 and a molecular weight of 292.16 g/mol. Its IUPAC name is 1-pentylpyridin-4-imine;hydroiodide.

Molecular Properties

Compound Name1-pentylpyridin-4-imine;hydroiodide
PubChem CID6603239
Molecular FormulaC10H17IN2
Molecular Weight292.16 g/mol
Exact Mass292.04
IUPAC Name1-pentylpyridin-4-imine;hydroiodide
SMILESI.[H]N=c1ccn(CCCCC)cc1
InChIInChI=1S/C10H16N2.HI/c1-2-3-4-7-12-8-5-10(11)6-9-12;/h5-6,8-9,11H,2-4,7H2,1H3;1H
InChIKeyNQUBFIZJIXNMEI-UHFFFAOYSA-N
XLogP2.78
TPSA28.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.16
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Octyl-1H-pyridin-4-ylideneamine
CID 16682157
1-Heptyl-1H-pyridin-4-ylideneamine
CID 9551797
1-Nonyl-1H-pyridin-4-ylideneamine
CID 16682142
1-Decyl-1H-pyridin-4-ylideneamine
CID 16682221
1-hexylpyridin-4(1H)-imine hydrobromide
CID 6603240
1-dodecylpyridin-4(1H)-imine
CID 1878823
1-Dodecyl-1H-pyridin-4-ylideneamine
CID 16682136
1-Methylpyridin-4-imine;hydroiodide
CID 45926723
N,1-dihexylpyridin-4-imine;hydrobromide
CID 14576923
1-decylpyridin-4(1H)-imine
CID 534503
1-Hexylpyridin-4-imine
CID 657407
1-butylpyridin-4(1H)-imine
CID 1827817

Frequently Asked Questions

What is the IUPAC name of 1-pentylpyridin-4-imine;hydroiodide?
The IUPAC name of 1-pentylpyridin-4-imine;hydroiodide (CID 6603239) is 1-pentylpyridin-4-imine;hydroiodide.
What is the SMILES notation for 1-pentylpyridin-4-imine;hydroiodide?
The canonical SMILES for 1-pentylpyridin-4-imine;hydroiodide is I.[H]N=c1ccn(CCCCC)cc1.
What is the InChIKey of 1-pentylpyridin-4-imine;hydroiodide?
The InChIKey is NQUBFIZJIXNMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.HI/c1-2-3-4-7-12-8-5-10(11)6-9-12;/h5-6,8-9,11H,2-4,7H2,1H3;1H.
What are the key properties of 1-pentylpyridin-4-imine;hydroiodide?
1-pentylpyridin-4-imine;hydroiodide has a molecular weight of 292.16 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentylpyridin-4-imine;hydroiodide is sourced from PubChem (CID 6603239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).