2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide

C20H22N4O3 — CID 66967919

IUPAC2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide
SMILESCC(C)(CO)c1cc(NC(=O)Cc2ccc(-c3ccc(N)nc3)cc2)on1
InChIInChI=1S/C20H22N4O3/c1-20(2,12-25)16-10-19(27-24-16)23-18(26)9-13-3-5-14(6-4-13)15-7-8-17(21)22-11-15/h3-8,10-11,25H,9,12H2,1-2H3,(H2,21,22)(H,23,26)
InChIKeyDRHLEUPIJBQGSY-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.77
Rot. Bonds6

About 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide

2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide (PubChem CID 66967919) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide.

Molecular Properties

Compound Name2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide
PubChem CID66967919
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide
SMILESCC(C)(CO)c1cc(NC(=O)Cc2ccc(-c3ccc(N)nc3)cc2)on1
InChIInChI=1S/C20H22N4O3/c1-20(2,12-25)16-10-19(27-24-16)23-18(26)9-13-3-5-14(6-4-13)15-7-8-17(21)22-11-15/h3-8,10-11,25H,9,12H2,1-2H3,(H2,21,22)(H,23,26)
InChIKeyDRHLEUPIJBQGSY-UHFFFAOYSA-N
XLogP2.77
TPSA114.27 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide 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-[4-(6-amino-3-pyridinyl)phenyl]-3-(3-tert-butyl-1,2-oxazol-5-yl)urea
CID 51030162
2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-fluorocyclobutyl)-1,2-oxazol-5-yl]acetamide
CID 71245920
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(4-chlorophenyl)acetamide
CID 59420457
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(4-prop-2-enoxyphenyl)acetamide
CID 59420462
[1-[3-[[2-[4-(6-amino-3-pyridinyl)phenyl]acetyl]amino]-1,2-oxazol-5-yl]cyclopropyl]methyl acetate
CID 66967916
2-[4-(4-amino-7-propan-2-ylpyrrolo[2,1-f][1,2,4]triazin-5-yl)phenyl]-N-(3-tert-butyl-1,2-oxazol-5-yl)acetamide
CID 167585624
1-[4-(6-amino-3-pyridinyl)phenyl]-3-[3-(1-hydroxy-2-methylpropan-2-yl)-1-methylpyrazol-5-yl]urea;methanesulfonic acid
CID 173035076
2-[4-(6-amino-5-methyl-3-pyridinyl)phenyl]-N-(5-tert-butyl-1,2-oxazol-3-yl)acetamide;methanesulfonic acid
CID 162340095
2-[4-(6-amino-5-fluoro-3-pyridinyl)phenyl]-N-[3-(3-methyloxetan-3-yl)-1,2-oxazol-5-yl]acetamide
CID 89401040
[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxoethyl] 2-(4-ethoxyphenyl)acetate
CID 18227468
2-[4-(6-amino-2-methoxy-3-pyridinyl)phenyl]-N-(5-tert-butyl-1,2-oxazol-3-yl)acetamide
CID 66967674
ethane;N-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]propanamide
CID 170582956

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide?
The IUPAC name of 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide (CID 66967919) is 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide.
What is the SMILES notation for 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide?
The canonical SMILES for 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide is CC(C)(CO)c1cc(NC(=O)Cc2ccc(-c3ccc(N)nc3)cc2)on1.
What is the InChIKey of 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide?
The InChIKey is DRHLEUPIJBQGSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-20(2,12-25)16-10-19(27-24-16)23-18(26)9-13-3-5-14(6-4-13)15-7-8-17(21)22-11-15/h3-8,10-11,25H,9,12H2,1-2H3,(H2,21,22)(H,23,26).
What are the key properties of 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide?
2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide has a molecular weight of 366.42 g/mol, XLogP of 2.77, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-amino-3-pyridinyl)phenyl]-N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide is sourced from PubChem (CID 66967919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).