2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide

C23H19N3O5 — CID 90515253

IUPAC2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide
SMILESO=C(NCc1ccc(OCc2ccccc2)cc1)c1coc(NC(=O)c2ccco2)n1
InChIInChI=1S/C23H19N3O5/c27-21(19-15-31-23(25-19)26-22(28)20-7-4-12-29-20)24-13-16-8-10-18(11-9-16)30-14-17-5-2-1-3-6-17/h1-12,15H,13-14H2,(H,24,27)(H,25,26,28)
InChIKeyBXZDGBKEUYCULY-UHFFFAOYSA-N
MW417.42 g/mol
LogP4.03
Rot. Bonds8

About 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide

2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 90515253) has the molecular formula C23H19N3O5 and a molecular weight of 417.42 g/mol. Its IUPAC name is 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID90515253
Molecular FormulaC23H19N3O5
Molecular Weight417.42 g/mol
Exact Mass417.13
IUPAC Name2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide
SMILESO=C(NCc1ccc(OCc2ccccc2)cc1)c1coc(NC(=O)c2ccco2)n1
InChIInChI=1S/C23H19N3O5/c27-21(19-15-31-23(25-19)26-22(28)20-7-4-12-29-20)24-13-16-8-10-18(11-9-16)30-14-17-5-2-1-3-6-17/h1-12,15H,13-14H2,(H,24,27)(H,25,26,28)
InChIKeyBXZDGBKEUYCULY-UHFFFAOYSA-N
XLogP4.03
TPSA106.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.42
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4-fluorophenoxy)ethyl]-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515090
N-[2-(4-chlorophenyl)ethyl]-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515222
2-(furan-2-carbonylamino)-N-propan-2-yl-1,3-oxazole-4-carboxamide
CID 90515122
2-(furan-2-carbonylamino)-N-[2-(3-methoxyphenyl)ethyl]-1,3-oxazole-4-carboxamide
CID 90515219
N-[2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 17440926
5-(furan-2-carbonylamino)-1-methyl-N-(4-phenylmethoxyphenyl)pyrazole-3-carboxamide
CID 51998966
N-[[3-(furan-2-carbonylamino)phenyl]methyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 46401322
N-[4-methyl-5-[[4-(pyridin-3-ylmethoxy)phenyl]methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 55708149
N-[[4-(2-methylpropoxy)phenyl]methyl]furan-2-carboxamide
CID 110781155
methyl 4-[[4-(furan-2-carbonylamino)phenoxy]methyl]benzoate
CID 112787723
N-[(4-phenylmethoxyphenyl)methyl]-2-(pyrimidin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90506073
N-[(4-phenylmethoxyphenyl)methyl]pyridine-3-carboxamide
CID 23130542

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide (CID 90515253) is 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide is O=C(NCc1ccc(OCc2ccccc2)cc1)c1coc(NC(=O)c2ccco2)n1.
What is the InChIKey of 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is BXZDGBKEUYCULY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O5/c27-21(19-15-31-23(25-19)26-22(28)20-7-4-12-29-20)24-13-16-8-10-18(11-9-16)30-14-17-5-2-1-3-6-17/h1-12,15H,13-14H2,(H,24,27)(H,25,26,28).
What are the key properties of 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide?
2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 417.42 g/mol, XLogP of 4.03, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-carbonylamino)-N-[(4-phenylmethoxyphenyl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 90515253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).