N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide

C24H26N2O3 — CID 108809136

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCC(C)c1ccc(-c2cnc(CCC(=O)NC3CCOc4ccccc43)o2)cc1
InChIInChI=1S/C24H26N2O3/c1-16(2)17-7-9-18(10-8-17)22-15-25-24(29-22)12-11-23(27)26-20-13-14-28-21-6-4-3-5-19(20)21/h3-10,15-16,20H,11-14H2,1-2H3,(H,26,27)
InChIKeyMMNHGPNOQRAAIS-UHFFFAOYSA-N
MW390.48 g/mol
LogP5.04
Rot. Bonds6

About N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide

N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide (PubChem CID 108809136) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
PubChem CID108809136
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCC(C)c1ccc(-c2cnc(CCC(=O)NC3CCOc4ccccc43)o2)cc1
InChIInChI=1S/C24H26N2O3/c1-16(2)17-7-9-18(10-8-17)22-15-25-24(29-22)12-11-23(27)26-20-13-14-28-21-6-4-3-5-19(20)21/h3-10,15-16,20H,11-14H2,1-2H3,(H,26,27)
InChIKeyMMNHGPNOQRAAIS-UHFFFAOYSA-N
XLogP5.04
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.48
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide 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

N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide
CID 26238912
N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 24598370
N-(1-phenylethyl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
CID 108784776
N-(oxolan-2-ylmethyl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
CID 108784774
N-benzyl-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
CID 108784781
3-(5-phenyl-1,3-oxazol-2-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 51309921
N-(2-morpholin-4-ylphenyl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
CID 108784875
3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]-N-prop-2-enylpropanamide
CID 108784863
trans-(1S,2R)-2-[[3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanoylamino]methyl]cyclohexane-1-carboxylic acid
CID 108809128
N-(6-methyl-2-pyridinyl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
CID 108798165
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide
CID 9159591
N-[3-(dimethylamino)propyl]-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
CID 108784851

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide (CID 108809136) is N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide is CC(C)c1ccc(-c2cnc(CCC(=O)NC3CCOc4ccccc43)o2)cc1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide?
The InChIKey is MMNHGPNOQRAAIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-16(2)17-7-9-18(10-8-17)22-15-25-24(29-22)12-11-23(27)26-20-13-14-28-21-6-4-3-5-19(20)21/h3-10,15-16,20H,11-14H2,1-2H3,(H,26,27).
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide?
N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide has a molecular weight of 390.48 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide is sourced from PubChem (CID 108809136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).