(6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone

C17H15N5O2 — CID 86783282

IUPAC(6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone
SMILESCc1ccc2c(n1)OCCN2C(=O)c1ccc(-n2ccnc2)nc1
InChIInChI=1S/C17H15N5O2/c1-12-2-4-14-16(20-12)24-9-8-22(14)17(23)13-3-5-15(19-10-13)21-7-6-18-11-21/h2-7,10-11H,8-9H2,1H3
InChIKeyHWBDLKRRAOTYDG-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.01
Rot. Bonds2

About (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone

(6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone (PubChem CID 86783282) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone.

Molecular Properties

Compound Name(6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone
PubChem CID86783282
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name(6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone
SMILESCc1ccc2c(n1)OCCN2C(=O)c1ccc(-n2ccnc2)nc1
InChIInChI=1S/C17H15N5O2/c1-12-2-4-14-16(20-12)24-9-8-22(14)17(23)13-3-5-15(19-10-13)21-7-6-18-11-21/h2-7,10-11H,8-9H2,1H3
InChIKeyHWBDLKRRAOTYDG-UHFFFAOYSA-N
XLogP2.01
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone with MolForge

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Related Compounds

(4-imidazol-1-ylphenyl)-(7-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)methanone
CID 71874012
(4-hydroxypiperidin-1-yl)-(6-imidazol-1-yl-3-pyridinyl)methanone
CID 43417527
(4-ethylphenyl)-[4-(6-imidazol-1-ylpyridine-3-carbonyl)piperazin-1-yl]methanone
CID 32772858
[(4R)-4-hydroxyazepan-1-yl]-(6-imidazol-1-yl-3-pyridinyl)methanone
CID 129353584
(2R)-1-(6-imidazol-1-ylpyridine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 78921306
(6-imidazol-1-yl-3-pyridinyl)-(3-methylpiperazin-1-yl)methanone
CID 119580052
ethyl (2R)-1-(6-imidazol-1-ylpyridine-3-carbonyl)pyrrolidine-2-carboxylate
CID 97314443
N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181
(6-imidazol-1-yl-3-pyridinyl)-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 110105279
(2R)-4-(6-imidazol-1-ylpyridine-3-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide
CID 124939923
ethane;6-imidazol-1-yl-N-methylpyridine-3-carboxamide
CID 142231779
(6-imidazol-1-yl-3-pyridinyl)-[(5R)-5-methoxy-1-oxa-9-azaspiro[5.5]undecan-9-yl]methanone
CID 124963732

Frequently Asked Questions

What is the IUPAC name of (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone?
The IUPAC name of (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone (CID 86783282) is (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone.
What is the SMILES notation for (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone?
The canonical SMILES for (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone is Cc1ccc2c(n1)OCCN2C(=O)c1ccc(-n2ccnc2)nc1.
What is the InChIKey of (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone?
The InChIKey is HWBDLKRRAOTYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-12-2-4-14-16(20-12)24-9-8-22(14)17(23)13-3-5-15(19-10-13)21-7-6-18-11-21/h2-7,10-11H,8-9H2,1H3.
What are the key properties of (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone?
(6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone has a molecular weight of 321.34 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6-imidazol-1-yl-3-pyridinyl)-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)methanone is sourced from PubChem (CID 86783282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).