4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol

C19H19N3O — CID 15857587

IUPAC4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol
SMILESOCCCCc1cc(-c2ccccn2)nc(-c2ccccn2)c1
InChIInChI=1S/C19H19N3O/c23-12-6-3-7-15-13-18(16-8-1-4-10-20-16)22-19(14-15)17-9-2-5-11-21-17/h1-2,4-5,8-11,13-14,23H,3,6-7,12H2
InChIKeyMKBWYLDVOFVUFX-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.52
Rot. Bonds6

About 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol

4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol (PubChem CID 15857587) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol.

Molecular Properties

Compound Name4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol
PubChem CID15857587
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol
SMILESOCCCCc1cc(-c2ccccn2)nc(-c2ccccn2)c1
InChIInChI=1S/C19H19N3O/c23-12-6-3-7-15-13-18(16-8-1-4-10-20-16)22-19(14-15)17-9-2-5-11-21-17/h1-2,4-5,8-11,13-14,23H,3,6-7,12H2
InChIKeyMKBWYLDVOFVUFX-UHFFFAOYSA-N
XLogP3.52
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

cobalt(2+);bis(5-(2,6-dipyridin-2-yl-4-pyridinyl)pentane-1-thiol)
CID 139250043
bis(2-[(2,6-dipyridin-2-yl-4-pyridinyl)-(2-hydroxyethyl)amino]ethanol);manganese;dichloride
CID 160501171
[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]methanol
CID 71437815
5-(2-pyridin-2-yl-4-pyridinyl)pentanoic acid
CID 121355471
9-pyridin-2-ylnonan-1-ol
CID 12680899
2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-[2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-pyridinyl]pyridine
CID 15448140
2,4,6-tripyridin-2-ylpyrimidine
CID 70005539
4-chloro-2,6-dipyridin-2-ylpyridine;platinum
CID 87267165
4-[6-[6-(2,6-dipyridin-2-yl-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]-2,6-dipyridin-2-ylpyridine
CID 171935887
4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716
3-[3-(3-hydroxypropyl)-5-(2-pyridin-2-ylethenyl)phenyl]propan-1-ol
CID 91123547
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol?
The IUPAC name of 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol (CID 15857587) is 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol.
What is the SMILES notation for 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol?
The canonical SMILES for 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol is OCCCCc1cc(-c2ccccn2)nc(-c2ccccn2)c1.
What is the InChIKey of 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol?
The InChIKey is MKBWYLDVOFVUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c23-12-6-3-7-15-13-18(16-8-1-4-10-20-16)22-19(14-15)17-9-2-5-11-21-17/h1-2,4-5,8-11,13-14,23H,3,6-7,12H2.
What are the key properties of 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol?
4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol has a molecular weight of 305.38 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dipyridin-2-yl-4-pyridinyl)butan-1-ol is sourced from PubChem (CID 15857587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).