2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide

C23H24N2O4 — CID 45208937

IUPAC2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
SMILESCOc1ccc(OCc2nc(C(=O)N(C)C3CCCc4ccccc43)co2)cc1
InChIInChI=1S/C23H24N2O4/c1-25(21-9-5-7-16-6-3-4-8-19(16)21)23(26)20-14-29-22(24-20)15-28-18-12-10-17(27-2)11-13-18/h3-4,6,8,10-14,21H,5,7,9,15H2,1-2H3
InChIKeyFUEIWPNIBUWNLN-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.41
Rot. Bonds6

About 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide

2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide (PubChem CID 45208937) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
PubChem CID45208937
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC Name2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
SMILESCOc1ccc(OCc2nc(C(=O)N(C)C3CCCc4ccccc43)co2)cc1
InChIInChI=1S/C23H24N2O4/c1-25(21-9-5-7-16-6-3-4-8-19(16)21)23(26)20-14-29-22(24-20)15-28-18-12-10-17(27-2)11-13-18/h3-4,6,8,10-14,21H,5,7,9,15H2,1-2H3
InChIKeyFUEIWPNIBUWNLN-UHFFFAOYSA-N
XLogP4.41
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-N-methylbenzamide
CID 18283889
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5-chloro-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazine-2-carboxamide
CID 107371805
N-ethyl-N-(2-hydroxyethyl)-2-[(4-methoxyphenoxy)methyl]-1,3-oxazole-4-carboxamide
CID 72881785
2-[(4-chlorophenoxy)methyl]-N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-thiazole-4-carboxamide
CID 55538028
N-(dicyclopropylmethyl)-2-[(4-fluorophenoxy)methyl]-N-methyl-1,3-oxazole-4-carboxamide
CID 25375834
N-methyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
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CID 45240952
N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide
CID 138997641
N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-4-carboxamide
CID 42916496
2-[(4-methoxyphenoxy)methyl]-N-propan-2-yl-1,3-oxazole-4-carboxamide
CID 42526219
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CID 42519824

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide (CID 45208937) is 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide is COc1ccc(OCc2nc(C(=O)N(C)C3CCCc4ccccc43)co2)cc1.
What is the InChIKey of 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
The InChIKey is FUEIWPNIBUWNLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-25(21-9-5-7-16-6-3-4-8-19(16)21)23(26)20-14-29-22(24-20)15-28-18-12-10-17(27-2)11-13-18/h3-4,6,8,10-14,21H,5,7,9,15H2,1-2H3.
What are the key properties of 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenoxy)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 45208937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).