(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone

C19H15N5O2 — CID 170502772

IUPAC(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone
SMILESO=C(c1ccn2ncnc2c1)N1CCc2oc(-c3ccccc3)nc2C1
InChIInChI=1S/C19H15N5O2/c25-19(14-6-9-24-17(10-14)20-12-21-24)23-8-7-16-15(11-23)22-18(26-16)13-4-2-1-3-5-13/h1-6,9-10,12H,7-8,11H2
InChIKeyBQIUNLFDBCDEFH-UHFFFAOYSA-N
MW345.36 g/mol
LogP2.58
Rot. Bonds2

About (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone

(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone (PubChem CID 170502772) has the molecular formula C19H15N5O2 and a molecular weight of 345.36 g/mol. Its IUPAC name is (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone.

Molecular Properties

Compound Name(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone
PubChem CID170502772
Molecular FormulaC19H15N5O2
Molecular Weight345.36 g/mol
Exact Mass345.12
IUPAC Name(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone
SMILESO=C(c1ccn2ncnc2c1)N1CCc2oc(-c3ccccc3)nc2C1
InChIInChI=1S/C19H15N5O2/c25-19(14-6-9-24-17(10-14)20-12-21-24)23-8-7-16-15(11-23)22-18(26-16)13-4-2-1-3-5-13/h1-6,9-10,12H,7-8,11H2
InChIKeyBQIUNLFDBCDEFH-UHFFFAOYSA-N
XLogP2.58
TPSA76.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone with MolForge

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Related Compounds

(3-methyl-1,2-oxazol-5-yl)-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 170504606
6-methyl-4-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine-5-carbonyl)-1H-pyridin-2-one
CID 170508120
(2,5-dimethylpyrazol-3-yl)-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 169414023
[4-(4-methylpiperazin-1-yl)phenyl]-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 169419453
(5-fluoro-2-pyridinyl)-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 170502779
(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-(1,3-thiazol-5-yl)methanone
CID 169417462
(1-ethylpyrazol-3-yl)-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 170504334
1,2-dimethyl-6-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine-5-carbonyl)pyridin-4-one
CID 170512533
[5-(difluoromethyl)-1H-pyrazol-3-yl]-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 170502438
(5-cyclopropyl-1H-pyrazol-3-yl)-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 170502326
4-[2-(3,5-difluorophenyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine-5-carbonyl]-1-methylpyridin-2-one
CID 170509508
oxolan-2-yl-(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)methanone
CID 169413850

Frequently Asked Questions

What is the IUPAC name of (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone?
The IUPAC name of (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone (CID 170502772) is (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone.
What is the SMILES notation for (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone?
The canonical SMILES for (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone is O=C(c1ccn2ncnc2c1)N1CCc2oc(-c3ccccc3)nc2C1.
What is the InChIKey of (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone?
The InChIKey is BQIUNLFDBCDEFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2/c25-19(14-6-9-24-17(10-14)20-12-21-24)23-8-7-16-15(11-23)22-18(26-16)13-4-2-1-3-5-13/h1-6,9-10,12H,7-8,11H2.
What are the key properties of (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone?
(2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone has a molecular weight of 345.36 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)-([1,2,4]triazolo[1,5-a]pyridin-7-yl)methanone is sourced from PubChem (CID 170502772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).