2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole

C21H24N4O — CID 146070741

IUPAC2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole
SMILESCc1cnc(-c2nn(Cc3ccccc3)c3c2CN(C2CCC2)CC3)o1
InChIInChI=1S/C21H24N4O/c1-15-12-22-21(26-15)20-18-14-24(17-8-5-9-17)11-10-19(18)25(23-20)13-16-6-3-2-4-7-16/h2-4,6-7,12,17H,5,8-11,13-14H2,1H3
InChIKeyLOVKOZFRLKMNAB-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.81
Rot. Bonds4

About 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole

2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole (PubChem CID 146070741) has the molecular formula C21H24N4O and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole
PubChem CID146070741
Molecular FormulaC21H24N4O
Molecular Weight348.45 g/mol
Exact Mass348.20
IUPAC Name2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole
SMILESCc1cnc(-c2nn(Cc3ccccc3)c3c2CN(C2CCC2)CC3)o1
InChIInChI=1S/C21H24N4O/c1-15-12-22-21(26-15)20-18-14-24(17-8-5-9-17)11-10-19(18)25(23-20)13-16-6-3-2-4-7-16/h2-4,6-7,12,17H,5,8-11,13-14H2,1H3
InChIKeyLOVKOZFRLKMNAB-UHFFFAOYSA-N
XLogP3.81
TPSA47.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole 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

1-[1-benzyl-3-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]propan-1-one
CID 146070746
ethyl 1-benzyl-5-(1-ethoxycarbonylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate
CID 26220369
N-cyclopentyl-1-ethyl-3-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide
CID 146067038
5-methyl-2-[1-methyl-5-[(4-propan-2-yloxyphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-1,3-oxazole
CID 146067008
cyclopentyl-[1-(2-ethoxyethyl)-3-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methanone
CID 146070710
1-[1-ethyl-3-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-2-thiophen-3-ylethanone
CID 146067102
[3-(5-methyl-1,3-oxazol-2-yl)-1-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-phenylmethanone
CID 146066968
1-[1-(2-ethoxyethyl)-3-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-2-(2-fluorophenyl)ethanone
CID 146070668
2-(3-chlorophenyl)-1-[3-(5-methyl-1,3-oxazol-2-yl)-1-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 146067119
1,5-dibenzyl-3-(4-chlorophenyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 11742503
3-(1-benzyl-5-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)aniline
CID 82585997
1-[1-(2-ethoxyethyl)-3-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-2-ethylbutan-1-one
CID 146070669

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole?
The IUPAC name of 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole (CID 146070741) is 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole.
What is the SMILES notation for 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole?
The canonical SMILES for 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole is Cc1cnc(-c2nn(Cc3ccccc3)c3c2CN(C2CCC2)CC3)o1.
What is the InChIKey of 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole?
The InChIKey is LOVKOZFRLKMNAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O/c1-15-12-22-21(26-15)20-18-14-24(17-8-5-9-17)11-10-19(18)25(23-20)13-16-6-3-2-4-7-16/h2-4,6-7,12,17H,5,8-11,13-14H2,1H3.
What are the key properties of 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole?
2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole has a molecular weight of 348.45 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzyl-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)-5-methyl-1,3-oxazole is sourced from PubChem (CID 146070741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).