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

C23H24N2O3 — CID 26238912

IUPACN-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)N[C@@H]3CCOc4ccccc43)o2)cc1C
InChIInChI=1S/C23H24N2O3/c1-15-7-8-17(13-16(15)2)21-14-24-23(28-21)10-9-22(26)25-19-11-12-27-20-6-4-3-5-18(19)20/h3-8,13-14,19H,9-12H2,1-2H3,(H,25,26)/t19-/m1/s1
InChIKeyVHIDFVDWUFNSQI-LJQANCHMSA-N
MW376.46 g/mol
LogP4.53
Rot. Bonds5

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

N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide (PubChem CID 26238912) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide.

Molecular Properties

Compound NameN-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide
PubChem CID26238912
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)N[C@@H]3CCOc4ccccc43)o2)cc1C
InChIInChI=1S/C23H24N2O3/c1-15-7-8-17(13-16(15)2)21-14-24-23(28-21)10-9-22(26)25-19-11-12-27-20-6-4-3-5-18(19)20/h3-8,13-14,19H,9-12H2,1-2H3,(H,25,26)/t19-/m1/s1
InChIKeyVHIDFVDWUFNSQI-LJQANCHMSA-N
XLogP4.53
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dihydro-2H-chromen-4-yl)-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propanamide
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3-amino-N-(3,4-dihydro-2H-chromen-4-yl)propanamide;hydrochloride
CID 119268905
N-(2-methylcyclohexyl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 24640348
N-(3,4-dihydro-2H-chromen-4-yl)-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide
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N-(3,4-dihydro-2H-chromen-4-yl)-3-thiophen-2-ylpropanamide
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1-[3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanoyl]-N-methylpiperidine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide?
The IUPAC name of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide (CID 26238912) is N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide.
What is the SMILES notation for N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide?
The canonical SMILES for N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide is Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3CCOc4ccccc43)o2)cc1C.
What is the InChIKey of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide?
The InChIKey is VHIDFVDWUFNSQI-LJQANCHMSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-15-7-8-17(13-16(15)2)21-14-24-23(28-21)10-9-22(26)25-19-11-12-27-20-6-4-3-5-18(19)20/h3-8,13-14,19H,9-12H2,1-2H3,(H,25,26)/t19-/m1/s1.
What are the key properties of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide?
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide has a molecular weight of 376.46 g/mol, XLogP of 4.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]propanamide is sourced from PubChem (CID 26238912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).