6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine

C24H20N4O — CID 58704182

IUPAC6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
SMILESc1ccc(N(c2cccc(-n3cccc3)c2)c2cccc(C3=NOCC3)n2)cc1
InChIInChI=1S/C24H20N4O/c1-2-8-19(9-3-1)28(21-11-6-10-20(18-21)27-15-4-5-16-27)24-13-7-12-22(25-24)23-14-17-29-26-23/h1-13,15-16,18H,14,17H2
InChIKeyRAQOUSZXGKUSMA-UHFFFAOYSA-N
MW380.45 g/mol
LogP5.47
Rot. Bonds5

About 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine

6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine (PubChem CID 58704182) has the molecular formula C24H20N4O and a molecular weight of 380.45 g/mol. Its IUPAC name is 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
PubChem CID58704182
Molecular FormulaC24H20N4O
Molecular Weight380.45 g/mol
Exact Mass380.16
IUPAC Name6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
SMILESc1ccc(N(c2cccc(-n3cccc3)c2)c2cccc(C3=NOCC3)n2)cc1
InChIInChI=1S/C24H20N4O/c1-2-8-19(9-3-1)28(21-11-6-10-20(18-21)27-15-4-5-16-27)24-13-7-12-22(25-24)23-14-17-29-26-23/h1-13,15-16,18H,14,17H2
InChIKeyRAQOUSZXGKUSMA-UHFFFAOYSA-N
XLogP5.47
TPSA42.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.45
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-phenyl-6-pyridin-2-yl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
CID 58704261
6-(1,2-benzoxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
CID 58704425
N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
CID 23135801
N-phenyl-6-pyrrol-1-yl-N-[3-(1,2-thiazol-3-yl)phenyl]pyridin-2-amine
CID 58704429
N,N-diphenyl-6-[9-[6-(N-phenylanilino)-2-pyridinyl]benzo[b]triphenylen-14-yl]pyridin-2-amine
CID 58855335
3-[3-(4,5-dihydro-1,2-oxazol-3-yl)phenyl]-4,5-dihydro-1,2-oxazole
CID 151374673
1-(3-pyrrol-1-ylphenyl)pyrrole
CID 91674731
6-(1-benzothiophen-2-yl)-N-phenyl-N-[1-(4-pyrazin-2-ylphenyl)pyrrol-3-yl]pyridin-2-amine
CID 59661018
6-methyl-N,N-diphenylpyridin-2-amine
CID 101223687
6-(3,4-dihydro-2H-pyrrol-5-yl)-N-phenyl-N-[3-(2H-pyrrol-2-id-1-yl)benzene-2-id-1-yl]pyridin-2-amine;platinum(2+)
CID 58704130
6-(1H-benzimidazol-2-yl)-N-[3-(1H-benzimidazol-2-yl)phenyl]-N-phenylpyridin-2-amine
CID 142374029
N,6-diphenyl-N-[6-(5,10,10-triphenylbenzo[b][1,4]benzazasilin-3-yl)-2-pyridinyl]pyridin-2-amine
CID 140752711

Frequently Asked Questions

What is the IUPAC name of 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine?
The IUPAC name of 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine (CID 58704182) is 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine.
What is the SMILES notation for 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine?
The canonical SMILES for 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine is c1ccc(N(c2cccc(-n3cccc3)c2)c2cccc(C3=NOCC3)n2)cc1.
What is the InChIKey of 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine?
The InChIKey is RAQOUSZXGKUSMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O/c1-2-8-19(9-3-1)28(21-11-6-10-20(18-21)27-15-4-5-16-27)24-13-7-12-22(25-24)23-14-17-29-26-23/h1-13,15-16,18H,14,17H2.
What are the key properties of 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine?
6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine has a molecular weight of 380.45 g/mol, XLogP of 5.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5-dihydro-1,2-oxazol-3-yl)-N-phenyl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine is sourced from PubChem (CID 58704182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).