N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide

C24H17N3O2 — CID 17336612

IUPACN-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide
SMILESO=C(NCc1ccc(-c2nc3ncccc3o2)cc1)c1cccc2ccccc12
InChIInChI=1S/C24H17N3O2/c28-23(20-8-3-6-17-5-1-2-7-19(17)20)26-15-16-10-12-18(13-11-16)24-27-22-21(29-24)9-4-14-25-22/h1-14H,15H2,(H,26,28)
InChIKeyRKOPXUVLWYAVSS-UHFFFAOYSA-N
MW379.42 g/mol
LogP4.97
Rot. Bonds4

About N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide

N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide (PubChem CID 17336612) has the molecular formula C24H17N3O2 and a molecular weight of 379.42 g/mol. Its IUPAC name is N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide
PubChem CID17336612
Molecular FormulaC24H17N3O2
Molecular Weight379.42 g/mol
Exact Mass379.13
IUPAC NameN-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide
SMILESO=C(NCc1ccc(-c2nc3ncccc3o2)cc1)c1cccc2ccccc12
InChIInChI=1S/C24H17N3O2/c28-23(20-8-3-6-17-5-1-2-7-19(17)20)26-15-16-10-12-18(13-11-16)24-27-22-21(29-24)9-4-14-25-22/h1-14H,15H2,(H,26,28)
InChIKeyRKOPXUVLWYAVSS-UHFFFAOYSA-N
XLogP4.97
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-5-iodo-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]benzamide
CID 17336639
2,3,5,6-tetrafluoro-4-methoxy-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]benzamide
CID 17336686
3-methoxy-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]benzamide
CID 17336615
N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]-3-propoxybenzamide
CID 6462401
5-bromo-2-methoxy-3-methyl-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methylcarbamothioyl]benzamide
CID 17336503
N-[[4-(1,3-benzoxazol-2-yl)phenyl]methyl]-2-fluorobenzamide
CID 2994943
3,5-dichloro-2-methoxy-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methylcarbamothioyl]benzamide
CID 17336495
3-butoxy-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methylcarbamothioyl]benzamide
CID 17336401
(E)-3-[5-(4-bromophenyl)furan-2-yl]-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]prop-2-enamide
CID 17336698
3-bromo-4-methoxy-N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methylcarbamothioyl]benzamide
CID 17336385
N-[[4-(methylsulfonylmethyl)phenyl]methyl]naphthalene-1-carboxamide
CID 60535333
ethane;2-phenyl-[1,3]oxazolo[4,5-b]pyridine
CID 91297789

Frequently Asked Questions

What is the IUPAC name of N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide?
The IUPAC name of N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide (CID 17336612) is N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide is O=C(NCc1ccc(-c2nc3ncccc3o2)cc1)c1cccc2ccccc12.
What is the InChIKey of N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide?
The InChIKey is RKOPXUVLWYAVSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N3O2/c28-23(20-8-3-6-17-5-1-2-7-19(17)20)26-15-16-10-12-18(13-11-16)24-27-22-21(29-24)9-4-14-25-22/h1-14H,15H2,(H,26,28).
What are the key properties of N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide?
N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide has a molecular weight of 379.42 g/mol, XLogP of 4.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]naphthalene-1-carboxamide is sourced from PubChem (CID 17336612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).