3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole

C19H23N5O — CID 154736743

IUPAC3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole
SMILESCC(C)c1nc2c(n1C)CCN(Cc1noc(-c3ccccc3)n1)C2
InChIInChI=1S/C19H23N5O/c1-13(2)18-20-15-11-24(10-9-16(15)23(18)3)12-17-21-19(25-22-17)14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3
InChIKeyKUQVCBQPCVNLGA-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.15
Rot. Bonds4

About 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole

3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole (PubChem CID 154736743) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole
PubChem CID154736743
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole
SMILESCC(C)c1nc2c(n1C)CCN(Cc1noc(-c3ccccc3)n1)C2
InChIInChI=1S/C19H23N5O/c1-13(2)18-20-15-11-24(10-9-16(15)23(18)3)12-17-21-19(25-22-17)14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3
InChIKeyKUQVCBQPCVNLGA-UHFFFAOYSA-N
XLogP3.15
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole 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,N-dimethyl-4-[[(E)-[1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxoindol-3-ylidene]amino]oxymethyl]benzamide
CID 45271884
5-[3,5-Bis(trifluoromethyl)phenyl]-3-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-1,2,4-oxadiazole
CID 57401702
3-(1-Tert-butyl-4,5,6,7-tetrahydrobenzotriazol-5-yl)-5-(4-fluorophenyl)-1,2,4-oxadiazole
CID 127035366
8-[(3R)-3-aminopiperidin-1-yl]-7-but-2-ynyl-3-methyl-1-[3-[4-(5-phenyl-1,2,4-oxadiazol-3-yl)piperazin-1-yl]propyl]purine-2,6-dione
CID 162663951
[2-(3-Methyl-1,2,4-oxadiazol-5-yl)phenyl]-[2-(4,5,6-trimethylpyrimidin-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]methanone
CID 67116349
[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methanone
CID 67116583
5-Phenyl-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 13715708
3-(2-Benzimidazol-1-yl)ethyl-5-phenyl-1,2,4-oxadiazole
CID 44274479
N-[(3S)-1-(3-methylpyrrolo[1,2-a]pyrazin-1-yl)pyrrolidin-3-yl]-5-phenyl-1,2,4-oxadiazole-3-carboxamide
CID 90192102
N-[(3S)-1-(8-methylpyrrolo[1,2-a]pyrazin-1-yl)pyrrolidin-3-yl]-5-phenyl-1,2,4-oxadiazole-3-carboxamide
CID 90192114
US11352339, Example 154
CID 141720564
2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1H-benzimidazole
CID 18576919

Frequently Asked Questions

What is the IUPAC name of 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole?
The IUPAC name of 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole (CID 154736743) is 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole.
What is the SMILES notation for 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole?
The canonical SMILES for 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole is CC(C)c1nc2c(n1C)CCN(Cc1noc(-c3ccccc3)n1)C2.
What is the InChIKey of 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole?
The InChIKey is KUQVCBQPCVNLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-13(2)18-20-15-11-24(10-9-16(15)23(18)3)12-17-21-19(25-22-17)14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3.
What are the key properties of 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole?
3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole has a molecular weight of 337.43 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-phenyl-1,2,4-oxadiazole is sourced from PubChem (CID 154736743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).