N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide

C17H15N3O3 — CID 122141693

IUPACN-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide
SMILESO=C(NCc1ccno1)c1ccnc(OCc2ccccc2)c1
InChIInChI=1S/C17H15N3O3/c21-17(19-11-15-7-9-20-23-15)14-6-8-18-16(10-14)22-12-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,19,21)
InChIKeyZERMNXJGTKTIKH-UHFFFAOYSA-N
MW309.33 g/mol
LogP2.58
Rot. Bonds6

About N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide

N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide (PubChem CID 122141693) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide
PubChem CID122141693
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide
SMILESO=C(NCc1ccno1)c1ccnc(OCc2ccccc2)c1
InChIInChI=1S/C17H15N3O3/c21-17(19-11-15-7-9-20-23-15)14-6-8-18-16(10-14)22-12-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,19,21)
InChIKeyZERMNXJGTKTIKH-UHFFFAOYSA-N
XLogP2.58
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-phenylmethoxypyridine-4-carboxamide
CID 47366269
N-[[2-(hydroxymethyl)phenyl]methyl]-2-phenylmethoxypyridine-4-carboxamide
CID 110908784
4-(1,2-oxazol-5-ylmethylcarbamoyl)pyridine-2-carboxylic acid
CID 106422085
N-[(2-phenylmethoxy-4-pyridinyl)methyl]benzamide
CID 46466541
2-chloro-N-(1,2-oxazol-5-ylmethyl)pyridine-4-carboxamide
CID 103939725
N-methoxy-2-phenylmethoxypyridine-4-carboxamide
CID 47366546
N-[(2-phenylmethoxy-4-pyridinyl)methyl]furan-3-carboxamide
CID 46475605
N-[(3-methyloxetan-3-yl)methyl]-2-phenylmethoxypyridine-4-carboxamide
CID 99122923
N-[(2-phenylmethoxy-4-pyridinyl)methyl]-4-(trifluoromethyl)benzamide
CID 46469686
N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide
CID 55996835
4-(1,2-oxazol-5-ylmethylcarbamoyl)benzoic acid
CID 106422079
3-amino-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 106413441

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide?
The IUPAC name of N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide (CID 122141693) is N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide.
What is the SMILES notation for N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide?
The canonical SMILES for N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide is O=C(NCc1ccno1)c1ccnc(OCc2ccccc2)c1.
What is the InChIKey of N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide?
The InChIKey is ZERMNXJGTKTIKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c21-17(19-11-15-7-9-20-23-15)14-6-8-18-16(10-14)22-12-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,19,21).
What are the key properties of N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide?
N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide is sourced from PubChem (CID 122141693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).