5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide

C24H27N5O3 — CID 165090926

IUPAC5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)n1nc(-c2ccc(CC(=O)Cc3cc(C45CC(C4)C5)no3)cc2)c(C(N)=O)c1N
InChIInChI=1S/C24H27N5O3/c1-13(2)29-22(25)20(23(26)31)21(27-29)16-5-3-14(4-6-16)7-17(30)8-18-9-19(28-32-18)24-10-15(11-24)12-24/h3-6,9,13,15H,7-8,10-12,25H2,1-2H3,(H2,26,31)
InChIKeyWRNWSNGAPGJTHQ-UHFFFAOYSA-N
MW433.51 g/mol
LogP3.21
Rot. Bonds8

About 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide

5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 165090926) has the molecular formula C24H27N5O3 and a molecular weight of 433.51 g/mol. Its IUPAC name is 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
PubChem CID165090926
Molecular FormulaC24H27N5O3
Molecular Weight433.51 g/mol
Exact Mass433.21
IUPAC Name5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)n1nc(-c2ccc(CC(=O)Cc3cc(C45CC(C4)C5)no3)cc2)c(C(N)=O)c1N
InChIInChI=1S/C24H27N5O3/c1-13(2)29-22(25)20(23(26)31)21(27-29)16-5-3-14(4-6-16)7-17(30)8-18-9-19(28-32-18)24-10-15(11-24)12-24/h3-6,9,13,15H,7-8,10-12,25H2,1-2H3,(H2,26,31)
InChIKeyWRNWSNGAPGJTHQ-UHFFFAOYSA-N
XLogP3.21
TPSA130.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.51
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide 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

5-amino-3-[4-[3-[3-(2,2-dimethylcyclopropyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 165037193
5-amino-3-[4-[3-(3-cyclopentyl-1,2-oxazol-5-yl)-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 164971281
5-amino-3-[4-[2-oxo-3-(3-spiro[3.3]heptan-2-yl-1,2-oxazol-5-yl)propyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 164976160
5-amino-3-[4-[2-oxo-3-[3-(2,4,6-trifluorophenyl)-1,2-oxazol-5-yl]propyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 164988000
5-amino-3-[4-[2-[[3-(1-bicyclo[1.1.0]butanylmethyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 167058943
5-amino-3-[4-[2-oxo-2-[(3-spiro[3.3]heptan-2-yl-1,2-oxazol-5-yl)amino]ethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 164765585
5-amino-3-[4-[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 163291915
5-amino-3-[4-[2-[(3-benzyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 163292118
5-amino-3-[4-[2-oxo-2-[(5-phenyl-1,2-oxazol-3-yl)amino]ethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 164765399
5-amino-3-[4-[2-[[3-(cyclohexylmethyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 163292154
5-amino-3-[4-[2-oxo-3-[5-(trifluoromethyl)-3-pyridinyl]propyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 165091400
5-amino-3-[4-[2-[[3-(4-fluorobutyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 167059300

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide (CID 165090926) is 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide is CC(C)n1nc(-c2ccc(CC(=O)Cc3cc(C45CC(C4)C5)no3)cc2)c(C(N)=O)c1N.
What is the InChIKey of 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is WRNWSNGAPGJTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N5O3/c1-13(2)29-22(25)20(23(26)31)21(27-29)16-5-3-14(4-6-16)7-17(30)8-18-9-19(28-32-18)24-10-15(11-24)12-24/h3-6,9,13,15H,7-8,10-12,25H2,1-2H3,(H2,26,31).
What are the key properties of 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 433.51 g/mol, XLogP of 3.21, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-[4-[3-[3-(1-bicyclo[1.1.1]pentanyl)-1,2-oxazol-5-yl]-2-oxopropyl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 165090926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).