5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide

C24H24FN7O3 — CID 164607714

IUPAC5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCc1ccc(-c2cc(NC(=O)Cc3ccc(-c4nn(C(C)C)c(N)c4C(N)=O)cn3)on2)c(F)c1
InChIInChI=1S/C24H24FN7O3/c1-12(2)32-23(26)21(24(27)34)22(30-32)14-5-6-15(28-11-14)9-19(33)29-20-10-18(31-35-20)16-7-4-13(3)8-17(16)25/h4-8,10-12H,9,26H2,1-3H3,(H2,27,34)(H,29,33)
InChIKeyGYCCWVZGHIXKBN-UHFFFAOYSA-N
MW477.50 g/mol
LogP3.49
Rot. Bonds7

About 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide

5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 164607714) has the molecular formula C24H24FN7O3 and a molecular weight of 477.50 g/mol. Its IUPAC name is 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide
PubChem CID164607714
Molecular FormulaC24H24FN7O3
Molecular Weight477.50 g/mol
Exact Mass477.19
IUPAC Name5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCc1ccc(-c2cc(NC(=O)Cc3ccc(-c4nn(C(C)C)c(N)c4C(N)=O)cn3)on2)c(F)c1
InChIInChI=1S/C24H24FN7O3/c1-12(2)32-23(26)21(24(27)34)22(30-32)14-5-6-15(28-11-14)9-19(33)29-20-10-18(31-35-20)16-7-4-13(3)8-17(16)25/h4-8,10-12H,9,26H2,1-3H3,(H2,27,34)(H,29,33)
InChIKeyGYCCWVZGHIXKBN-UHFFFAOYSA-N
XLogP3.49
TPSA154.95 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.50
LogP ≤ 53.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-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

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide (CID 164607714) is 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide is Cc1ccc(-c2cc(NC(=O)Cc3ccc(-c4nn(C(C)C)c(N)c4C(N)=O)cn3)on2)c(F)c1.
What is the InChIKey of 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is GYCCWVZGHIXKBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN7O3/c1-12(2)32-23(26)21(24(27)34)22(30-32)14-5-6-15(28-11-14)9-19(33)29-20-10-18(31-35-20)16-7-4-13(3)8-17(16)25/h4-8,10-12H,9,26H2,1-3H3,(H2,27,34)(H,29,33).
What are the key properties of 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide?
5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 477.50 g/mol, XLogP of 3.49, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-[6-[2-[[3-(2-fluoro-4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3-pyridinyl]-1-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 164607714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).