3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine

C26H26N4 — CID 25260942

IUPAC3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine
SMILESCC(C)N1CC=C(c2ccn3c(-c4ccnc(-c5ccccc5)c4)cnc3c2)CC1
InChIInChI=1S/C26H26N4/c1-19(2)29-13-9-20(10-14-29)22-11-15-30-25(18-28-26(30)17-22)23-8-12-27-24(16-23)21-6-4-3-5-7-21/h3-9,11-12,15-19H,10,13-14H2,1-2H3
InChIKeySCYXGFXNSHBYTR-UHFFFAOYSA-N
MW394.52 g/mol
LogP5.56
Rot. Bonds4

About 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine

3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine (PubChem CID 25260942) has the molecular formula C26H26N4 and a molecular weight of 394.52 g/mol. Its IUPAC name is 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine
PubChem CID25260942
Molecular FormulaC26H26N4
Molecular Weight394.52 g/mol
Exact Mass394.22
IUPAC Name3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine
SMILESCC(C)N1CC=C(c2ccn3c(-c4ccnc(-c5ccccc5)c4)cnc3c2)CC1
InChIInChI=1S/C26H26N4/c1-19(2)29-13-9-20(10-14-29)22-11-15-30-25(18-28-26(30)17-22)23-8-12-27-24(16-23)21-6-4-3-5-7-21/h3-9,11-12,15-19H,10,13-14H2,1-2H3
InChIKeySCYXGFXNSHBYTR-UHFFFAOYSA-N
XLogP5.56
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.52
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine (CID 25260942) is 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine is CC(C)N1CC=C(c2ccn3c(-c4ccnc(-c5ccccc5)c4)cnc3c2)CC1.
What is the InChIKey of 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine?
The InChIKey is SCYXGFXNSHBYTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4/c1-19(2)29-13-9-20(10-14-29)22-11-15-30-25(18-28-26(30)17-22)23-8-12-27-24(16-23)21-6-4-3-5-7-21/h3-9,11-12,15-19H,10,13-14H2,1-2H3.
What are the key properties of 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine?
3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine has a molecular weight of 394.52 g/mol, XLogP of 5.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenyl-4-pyridinyl)-7-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 25260942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).