2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide

C24H28N4O3 — CID 10409889

IUPAC2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
SMILESCOc1cc(Nc2ncc(-c3ccccc3CN(C)C(=O)CN)o2)ccc1C=C(C)C
InChIInChI=1S/C24H28N4O3/c1-16(2)11-17-9-10-19(12-21(17)30-4)27-24-26-14-22(31-24)20-8-6-5-7-18(20)15-28(3)23(29)13-25/h5-12,14H,13,15,25H2,1-4H3,(H,26,27)
InChIKeyHQAPSDQJAQCIDI-UHFFFAOYSA-N
MW420.51 g/mol
LogP4.43
Rot. Bonds8

About 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide

2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide (PubChem CID 10409889) has the molecular formula C24H28N4O3 and a molecular weight of 420.51 g/mol. Its IUPAC name is 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
PubChem CID10409889
Molecular FormulaC24H28N4O3
Molecular Weight420.51 g/mol
Exact Mass420.22
IUPAC Name2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
SMILESCOc1cc(Nc2ncc(-c3ccccc3CN(C)C(=O)CN)o2)ccc1C=C(C)C
InChIInChI=1S/C24H28N4O3/c1-16(2)11-17-9-10-19(12-21(17)30-4)27-24-26-14-22(31-24)20-8-6-5-7-18(20)15-28(3)23(29)13-25/h5-12,14H,13,15,25H2,1-4H3,(H,26,27)
InChIKeyHQAPSDQJAQCIDI-UHFFFAOYSA-N
XLogP4.43
TPSA93.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide 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

2-amino-N-[[2-[2-[3-ethyl-4-(1,3-oxazol-5-yl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
CID 10025760
methyl 5-[[5-[2-[[(2-aminoacetyl)-methylamino]methyl]phenyl]-1,3-oxazol-2-yl]amino]-2-(1,3-oxazol-2-yl)benzoate
CID 67559861
2-amino-N-methyl-N-[[2-[2-[4-(4-methyl-1,3-oxazol-2-yl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]acetamide
CID 10093415
2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide
CID 10385484
2-amino-N-[[2-[2-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
CID 10368518
ethyl 2-methoxy-4-[(5-phenyl-1,3-oxazol-2-yl)amino]benzoate
CID 139225247
2-amino-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 60718962
2-[1-[2-[2-[3-methoxy-4-(1,3-oxazol-5-yl)anilino]-1,3-oxazol-5-yl]phenyl]-1-methyl-1,2,4-triazol-1-ium-3-yl]acetamide
CID 90724983
2-[1-[2-[2-[3-methoxy-4-(1,3-oxazol-5-yl)anilino]-1,3-oxazol-5-yl]phenyl]-3-methyl-2H-imidazol-2-yl]acetamide
CID 90820920
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-[2-[2-[3-methoxy-4-(1,3-oxazol-5-yl)anilino]-1,3-oxazol-5-yl]phenyl]acetamide
CID 67046571
N-[2-[2-[4-(2,3-dihydro-1,3-oxazol-5-yl)-3-methoxyanilino]-1,3-oxazol-5-yl]phenyl]-N-methyl-2-morpholin-4-ylacetamide
CID 143318270
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-pyridin-2-yl-1,3-oxazol-2-amine
CID 10125842

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide?
The IUPAC name of 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide (CID 10409889) is 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide.
What is the SMILES notation for 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide?
The canonical SMILES for 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide is COc1cc(Nc2ncc(-c3ccccc3CN(C)C(=O)CN)o2)ccc1C=C(C)C.
What is the InChIKey of 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide?
The InChIKey is HQAPSDQJAQCIDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O3/c1-16(2)11-17-9-10-19(12-21(17)30-4)27-24-26-14-22(31-24)20-8-6-5-7-18(20)15-28(3)23(29)13-25/h5-12,14H,13,15,25H2,1-4H3,(H,26,27).
What are the key properties of 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide?
2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide has a molecular weight of 420.51 g/mol, XLogP of 4.43, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide is sourced from PubChem (CID 10409889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).