azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone

C15H14N4O2 — CID 178095219

IUPACazetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone
SMILESCc1ncoc1-c1ccc2cc(C(=O)N3CCC3)[nH]c2n1
InChIInChI=1S/C15H14N4O2/c1-9-13(21-8-16-9)11-4-3-10-7-12(18-14(10)17-11)15(20)19-5-2-6-19/h3-4,7-8H,2,5-6H2,1H3,(H,17,18)
InChIKeyDNJWSVMDPZYUFC-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.37
Rot. Bonds2

About azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone

azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone (PubChem CID 178095219) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone.

Molecular Properties

Compound Nameazetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone
PubChem CID178095219
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Nameazetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone
SMILESCc1ncoc1-c1ccc2cc(C(=O)N3CCC3)[nH]c2n1
InChIInChI=1S/C15H14N4O2/c1-9-13(21-8-16-9)11-4-3-10-7-12(18-14(10)17-11)15(20)19-5-2-6-19/h3-4,7-8H,2,5-6H2,1H3,(H,17,18)
InChIKeyDNJWSVMDPZYUFC-UHFFFAOYSA-N
XLogP2.37
TPSA75.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone with MolForge

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Related Compounds

chlorobenzene;morpholin-4-yl-[6-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone
CID 178095343
(7-methyl-1H-indol-2-yl)-morpholin-4-ylmethanone
CID 110849285
CID 66929366
CID 66929366
1-[2-(pyrrolidine-1-carbonyl)-1H-indol-6-yl]ethanone
CID 166245873
1,4-diazepan-1-yl-[5-(4-methylphenyl)-1,3-oxazol-4-yl]methanone
CID 119416396
(7-fluoro-6-propan-2-yl-1H-indol-2-yl)-pyrrolidin-1-ylmethanone
CID 176934102
(5-methyl-1H-indol-2-yl)-morpholin-4-ylmethanone
CID 4210929
[5-(4-fluorophenyl)-1,3-oxazol-4-yl]-pyrrolidin-1-ylmethanone
CID 110244642
1,4-diazepan-1-yl-[5-(4-methylphenyl)-1,3-oxazol-4-yl]methanone;dihydrochloride
CID 119416395
4-(2,5-dimethylphenyl)-6-(pyrrolidine-1-carbonyl)-1H-pyrimidin-2-one
CID 110332406
(5-methyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-morpholin-4-ylmethanone
CID 167445658
(6-ethoxy-1H-indol-2-yl)-morpholin-4-ylmethanone
CID 47265248

Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone?
The IUPAC name of azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone (CID 178095219) is azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone.
What is the SMILES notation for azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone?
The canonical SMILES for azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone is Cc1ncoc1-c1ccc2cc(C(=O)N3CCC3)[nH]c2n1.
What is the InChIKey of azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone?
The InChIKey is DNJWSVMDPZYUFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-9-13(21-8-16-9)11-4-3-10-7-12(18-14(10)17-11)15(20)19-5-2-6-19/h3-4,7-8H,2,5-6H2,1H3,(H,17,18).
What are the key properties of azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone?
azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone has a molecular weight of 282.30 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl-[6-(4-methyl-1,3-oxazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanone is sourced from PubChem (CID 178095219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).