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

C19H14N4O2 — CID 743073

IUPACN-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide
SMILESCc1ccc(-c2nc3ncccc3o2)cc1NC(=O)c1cccnc1
InChIInChI=1S/C19H14N4O2/c1-12-6-7-13(19-23-17-16(25-19)5-3-9-21-17)10-15(12)22-18(24)14-4-2-8-20-11-14/h2-11H,1H3,(H,22,24)
InChIKeyTYQNJGXZNGEFHV-UHFFFAOYSA-N
MW330.35 g/mol
LogP3.85
Rot. Bonds3

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

N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide (PubChem CID 743073) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide
PubChem CID743073
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC NameN-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide
SMILESCc1ccc(-c2nc3ncccc3o2)cc1NC(=O)c1cccnc1
InChIInChI=1S/C19H14N4O2/c1-12-6-7-13(19-23-17-16(25-19)5-3-9-21-17)10-15(12)22-18(24)14-4-2-8-20-11-14/h2-11H,1H3,(H,22,24)
InChIKeyTYQNJGXZNGEFHV-UHFFFAOYSA-N
XLogP3.85
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CA-4948
CID 118224238
YM-201636
CID 9956222
4-(Oxazolo[4,5-b]pyridin-2-yl)aniline
CID 486277
1-Oxazolo(4,5-b)pyridin-2-yl-6-phenyl-1-hexanone
CID 10085812
1-Heptanone, 1-oxazolo[4,5-b]pyridin-2-yl-7-phenyl-
CID 11150976
3-[4-(Benzyloxy)phenyl]-1-{pyrido[2,3-d][1,3]oxazol-2-yl}propan-1-one
CID 16736010
1-[6-(4-Methylphenyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]-6-phenylhexan-1-one
CID 122390213
3-(Oxazolo[4,5-b]pyridin-2-yl)aniline
CID 611086
2-methyl-N-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide
CID 694846
Oxazolo(4,5-b)pyridine, 2-(2-fluorophenyl)-
CID 1971814
6-[3-([1,3]oxazolo[4,5-B]pyridin-2-Yl)-2-(Trifluoromethyl)phenoxy]-1-(2,4,6-Trifluorobenzyl)quinazolin-4(1h)-One
CID 58439216
1-(Oxazolo[4,5-b]pyridin-2-yl)-8-phenyloctan-1-one
CID 22486206

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide (CID 743073) is N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide is Cc1ccc(-c2nc3ncccc3o2)cc1NC(=O)c1cccnc1.
What is the InChIKey of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide?
The InChIKey is TYQNJGXZNGEFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2/c1-12-6-7-13(19-23-17-16(25-19)5-3-9-21-17)10-15(12)22-18(24)14-4-2-8-20-11-14/h2-11H,1H3,(H,22,24).
What are the key properties of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide?
N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide has a molecular weight of 330.35 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 743073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).