2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine

C15H17N3 — CID 141002624

IUPAC2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine
SMILESC1=CC(C2=CNCC=C2)NC(C2=NC=CCC2)=C1
InChIInChI=1S/C15H17N3/c1-2-10-17-14(6-1)15-8-3-7-13(18-15)12-5-4-9-16-11-12/h2-5,7-8,10-11,13,16,18H,1,6,9H2
InChIKeySRDBUTNEBZEHNT-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.19
Rot. Bonds2

About 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine

2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine (PubChem CID 141002624) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine.

Molecular Properties

Compound Name2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine
PubChem CID141002624
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine
SMILESC1=CC(C2=CNCC=C2)NC(C2=NC=CCC2)=C1
InChIInChI=1S/C15H17N3/c1-2-10-17-14(6-1)15-8-3-7-13(18-15)12-5-4-9-16-11-12/h2-5,7-8,10-11,13,16,18H,1,6,9H2
InChIKeySRDBUTNEBZEHNT-UHFFFAOYSA-N
XLogP2.19
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine?
The IUPAC name of 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine (CID 141002624) is 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine.
What is the SMILES notation for 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine?
The canonical SMILES for 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine is C1=CC(C2=CNCC=C2)NC(C2=NC=CCC2)=C1.
What is the InChIKey of 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine?
The InChIKey is SRDBUTNEBZEHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-2-10-17-14(6-1)15-8-3-7-13(18-15)12-5-4-9-16-11-12/h2-5,7-8,10-11,13,16,18H,1,6,9H2.
What are the key properties of 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine?
2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine has a molecular weight of 239.32 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine is sourced from PubChem (CID 141002624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).