3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide

C21H16N2O4 — CID 20604821

IUPAC3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3ccccc3cc2O)ccc1-c1cnco1
InChIInChI=1S/C21H16N2O4/c1-26-19-10-15(6-7-16(19)20-11-22-12-27-20)23-21(25)17-8-13-4-2-3-5-14(13)9-18(17)24/h2-12,24H,1H3,(H,23,25)
InChIKeyBRZXRRUYPPZNNL-UHFFFAOYSA-N
MW360.37 g/mol
LogP4.46
Rot. Bonds4

About 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide

3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide (PubChem CID 20604821) has the molecular formula C21H16N2O4 and a molecular weight of 360.37 g/mol. Its IUPAC name is 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide
PubChem CID20604821
Molecular FormulaC21H16N2O4
Molecular Weight360.37 g/mol
Exact Mass360.11
IUPAC Name3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3ccccc3cc2O)ccc1-c1cnco1
InChIInChI=1S/C21H16N2O4/c1-26-19-10-15(6-7-16(19)20-11-22-12-27-20)23-21(25)17-8-13-4-2-3-5-14(13)9-18(17)24/h2-12,24H,1H3,(H,23,25)
InChIKeyBRZXRRUYPPZNNL-UHFFFAOYSA-N
XLogP4.46
TPSA84.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N'-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N-phenylpropanediamide
CID 10338010
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N'-[2-methyl-1-(naphthalene-1-carbonylamino)propan-2-yl]oxamide
CID 20766557
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-methyl-3-phenylbutanamide
CID 90177469
(E)-2-fluoro-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-phenylprop-2-enamide
CID 67047395
1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-nitrophenyl)urea
CID 15462733
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-pyridin-3-ylprop-2-enamide
CID 67046782
N-cyclobutyl-N'-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]oxamide
CID 20766949
N'-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N-(3-methylbutyl)oxamide
CID 20766963
1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-[(4-methylphenyl)methyl]urea
CID 12051287
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
CID 67046910
N-[4-[2-[2-[3-methoxy-4-(1,3-oxazol-5-yl)anilino]oxyethynoxyamino]-2-methylpropyl]phenyl]benzamide
CID 20766919
N-(1,3-dioxolan-2-ylmethyl)-N'-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]oxamide
CID 20766594

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide?
The IUPAC name of 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide (CID 20604821) is 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide?
The canonical SMILES for 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide is COc1cc(NC(=O)c2cc3ccccc3cc2O)ccc1-c1cnco1.
What is the InChIKey of 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide?
The InChIKey is BRZXRRUYPPZNNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O4/c1-26-19-10-15(6-7-16(19)20-11-22-12-27-20)23-21(25)17-8-13-4-2-3-5-14(13)9-18(17)24/h2-12,24H,1H3,(H,23,25).
What are the key properties of 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide?
3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide has a molecular weight of 360.37 g/mol, XLogP of 4.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 20604821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).